6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide

C20H23N3O — CID 166314331

IUPAC6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESNC1CCc2cc(C(=O)N[C@H]3CCCc4cccnc43)ccc2C1
InChIInChI=1S/C20H23N3O/c21-17-9-8-14-11-16(7-6-15(14)12-17)20(24)23-18-5-1-3-13-4-2-10-22-19(13)18/h2,4,6-7,10-11,17-18H,1,3,5,8-9,12,21H2,(H,23,24)/t17?,18-/m0/s1
InChIKeyHZRJMYIRNMBXOW-ZVAWYAOSSA-N
MW321.42 g/mol
LogP2.70
Rot. Bonds2

About 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide

6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide (PubChem CID 166314331) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
PubChem CID166314331
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESNC1CCc2cc(C(=O)N[C@H]3CCCc4cccnc43)ccc2C1
InChIInChI=1S/C20H23N3O/c21-17-9-8-14-11-16(7-6-15(14)12-17)20(24)23-18-5-1-3-13-4-2-10-22-19(13)18/h2,4,6-7,10-11,17-18H,1,3,5,8-9,12,21H2,(H,23,24)/t17?,18-/m0/s1
InChIKeyHZRJMYIRNMBXOW-ZVAWYAOSSA-N
XLogP2.70
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide with MolForge

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Related Compounds

N-[(8R)-5,6,7,8-tetrahydroquinolin-8-yl]propanamide
CID 165447452
4-fluoro-3-(5,6,7,8-tetrahydroquinolin-8-ylamino)benzoic acid
CID 79079889
2-(5,6,7,8-tetrahydroquinolin-8-ylamino)oxyacetamide
CID 112672973
1-(2-aminoethyl)-N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pyrazole-4-carboxamide
CID 129052542
(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 58985331
N-fluoro-5,6,7,8-tetrahydroquinolin-8-amine
CID 145471491
3-amino-6-methyl-5-(1,3-oxazol-2-yl)-N-(5,6,7,8-tetrahydroquinolin-8-yl)pyrazine-2-carboxamide
CID 121351019
5,5-dimethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-6,7-dihydro-4H-1,2-benzoxazole-3-carboxamide
CID 136586931
4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)benzamide
CID 102772556
6-amino-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-carboxamide
CID 62072949
2-amino-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-carboxamide
CID 62072951
N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 114615760

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide (CID 166314331) is 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide is NC1CCc2cc(C(=O)N[C@H]3CCCc4cccnc43)ccc2C1.
What is the InChIKey of 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The InChIKey is HZRJMYIRNMBXOW-ZVAWYAOSSA-N. The full InChI is InChI=1S/C20H23N3O/c21-17-9-8-14-11-16(7-6-15(14)12-17)20(24)23-18-5-1-3-13-4-2-10-22-19(13)18/h2,4,6-7,10-11,17-18H,1,3,5,8-9,12,21H2,(H,23,24)/t17?,18-/m0/s1.
What are the key properties of 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide has a molecular weight of 321.42 g/mol, XLogP of 2.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 166314331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).