(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine

C74H96N14O4 — CID 161482923

IUPAC(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
SMILESCN1CCN(c2cccc3nc(C=O)cn23)CC1.CN1CCNCC1.CN[C@H]1CCCc2cccnc21.COc1ccc([C@H](C)N(C)[C@H]2CCCc3cccnc32)cc1.COc1ccc([C@H](C)N[C@H]2CCCc3cccnc32)cc1.Cc1cccc2nc(C=O)cn12
InChIInChI=1S/C19H24N2O.C18H22N2O.C13H16N4O.C10H14N2.C9H8N2O.C5H12N2/c1-14(15-9-11-17(22-3)12-10-15)21(2)18-8-4-6-16-7-5-13-20-19(16)18;1-13(14-8-10-16(21-2)11-9-14)20-17-7-3-5-15-6-4-12-19-18(15)17;1-15-5-7-16(8-6-15)13-4-2-3-12-14-11(10-18)9-17(12)13;1-11-9-6-2-4-8-5-3-7-12-10(8)9;1-7-3-2-4-9-10-8(6-12)5-11(7)9;1-7-4-2-6-3-5-7/h5,7,9-14,18H,4,6,8H2,1-3H3;4,6,8-13,17,20H,3,5,7H2,1-2H3;2-4,9-10H,5-8H2,1H3;3,5,7,9,11H,2,4,6H2,1H3;2-6H,1H3;6H,2-5H2,1H3/t14-,18-;13-,17-;;9-;;/m00.0../s1
InChIKeyWEPHUXRVBLOVCG-ZWTGCJRFSA-N
MW1245.68 g/mol
LogP11.53
Rot. Bonds12

About (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine

(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine (PubChem CID 161482923) has the molecular formula C74H96N14O4 and a molecular weight of 1245.68 g/mol. Its IUPAC name is (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine.

Molecular Properties

Compound Name(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
PubChem CID161482923
Molecular FormulaC74H96N14O4
Molecular Weight1245.68 g/mol
Exact Mass1244.77
IUPAC Name(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
SMILESCN1CCN(c2cccc3nc(C=O)cn23)CC1.CN1CCNCC1.CN[C@H]1CCCc2cccnc21.COc1ccc([C@H](C)N(C)[C@H]2CCCc3cccnc32)cc1.COc1ccc([C@H](C)N[C@H]2CCCc3cccnc32)cc1.Cc1cccc2nc(C=O)cn12
InChIInChI=1S/C19H24N2O.C18H22N2O.C13H16N4O.C10H14N2.C9H8N2O.C5H12N2/c1-14(15-9-11-17(22-3)12-10-15)21(2)18-8-4-6-16-7-5-13-20-19(16)18;1-13(14-8-10-16(21-2)11-9-14)20-17-7-3-5-15-6-4-12-19-18(15)17;1-15-5-7-16(8-6-15)13-4-2-3-12-14-11(10-18)9-17(12)13;1-11-9-6-2-4-8-5-3-7-12-10(8)9;1-7-3-2-4-9-10-8(6-12)5-11(7)9;1-7-4-2-6-3-5-7/h5,7,9-14,18H,4,6,8H2,1-3H3;4,6,8-13,17,20H,3,5,7H2,1-2H3;2-4,9-10H,5-8H2,1H3;3,5,7,9,11H,2,4,6H2,1H3;2-6H,1H3;6H,2-5H2,1H3/t14-,18-;13-,17-;;9-;;/m00.0../s1
InChIKeyWEPHUXRVBLOVCG-ZWTGCJRFSA-N
XLogP11.53
TPSA174.92 Ų
H-Bond Donors3
H-Bond Acceptors18
Rotatable Bonds12
Heavy Atoms92
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001245.68
LogP ≤ 511.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine with MolForge

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Related Compounds

N-[(1S)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 164624196
N-[(1R)-1-(4-methoxyphenyl)ethyl]-6-quinolin-6-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 164628072
8-(4-Methoxyphenyl)-N-[2-(pyridin-2-YL)ethyl]imidazo[1,2-A]pyrazine-2-carboxamide
CID 53188916
(Z)-1-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-3-(quinolin-6-ylamino)prop-2-en-1-one
CID 145981160
(Z)-1-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-3-(quinolin-3-ylamino)prop-2-en-1-one
CID 145987260
8-(4-methoxyphenyl)-N-(3-pyridylmethyl)imidazo[1,2-a]pyrazine-2-carboxamide
CID 53188904
8-(4-Methoxyphenyl)-N-[2-(pyridin-3-YL)ethyl]imidazo[1,2-A]pyrazine-2-carboxamide
CID 53188918
8-(4-Methoxyphenyl)-N-[(1-methyl-1H-1,3-benzodiazol-2-YL)methyl]imidazo[1,2-A]pyrazine-2-carboxamide
CID 53188952
8-(4-Methoxyphenyl)-N-[2-(pyridin-4-YL)ethyl]imidazo[1,2-A]pyrazine-2-carboxamide
CID 53188919
1-[(4-Methoxyphenyl)methyl]-3-methyl-7-[(5-methyl-2-pyridinyl)methyl]-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-methyl-7-[(5-methyl-2-pyridinyl)methyl]-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione
CID 157273625
1-[(4-Methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione
CID 161693077
N-[2-[[6-[2-(3-carbamoylimidazo[1,2-a]pyridin-6-yl)-4-(2-fluorophenoxy)phenyl]-2-pyridinyl]methyl]cyclopropyl]-6-[2-(6-methyl-2-pyridinyl)phenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 163633481

Frequently Asked Questions

What is the IUPAC name of (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine?
The IUPAC name of (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine (CID 161482923) is (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine.
What is the SMILES notation for (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine?
The canonical SMILES for (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine is CN1CCN(c2cccc3nc(C=O)cn23)CC1.CN1CCNCC1.CN[C@H]1CCCc2cccnc21.COc1ccc([C@H](C)N(C)[C@H]2CCCc3cccnc32)cc1.COc1ccc([C@H](C)N[C@H]2CCCc3cccnc32)cc1.Cc1cccc2nc(C=O)cn12.
What is the InChIKey of (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine?
The InChIKey is WEPHUXRVBLOVCG-ZWTGCJRFSA-N. The full InChI is InChI=1S/C19H24N2O.C18H22N2O.C13H16N4O.C10H14N2.C9H8N2O.C5H12N2/c1-14(15-9-11-17(22-3)12-10-15)21(2)18-8-4-6-16-7-5-13-20-19(16)18;1-13(14-8-10-16(21-2)11-9-14)20-17-7-3-5-15-6-4-12-19-18(15)17;1-15-5-7-16(8-6-15)13-4-2-3-12-14-11(10-18)9-17(12)13;1-11-9-6-2-4-8-5-3-7-12-10(8)9;1-7-3-2-4-9-10-8(6-12)5-11(7)9;1-7-4-2-6-3-5-7/h5,7,9-14,18H,4,6,8H2,1-3H3;4,6,8-13,17,20H,3,5,7H2,1-2H3;2-4,9-10H,5-8H2,1H3;3,5,7,9,11H,2,4,6H2,1H3;2-6H,1H3;6H,2-5H2,1H3/t14-,18-;13-,17-;;9-;;/m00.0../s1.
What are the key properties of (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine?
(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine has a molecular weight of 1245.68 g/mol, XLogP of 11.53, 12 rotatable bonds, 3 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine;(8S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine;5-methylimidazo[1,2-a]pyridine-2-carbaldehyde;1-methylpiperazine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine is sourced from PubChem (CID 161482923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).