(2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine

C18H25N3 — CID 97087066

IUPAC(2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine
SMILESC[C@H](CCc1ccccc1)NC[C@H]1CCCn2ccnc21
InChIInChI=1S/C18H25N3/c1-15(9-10-16-6-3-2-4-7-16)20-14-17-8-5-12-21-13-11-19-18(17)21/h2-4,6-7,11,13,15,17,20H,5,8-10,12,14H2,1H3/t15-,17-/m1/s1
InChIKeyHUHSPNAWPQXJHW-NVXWUHKLSA-N
MW283.42 g/mol
LogP3.37
Rot. Bonds6

About (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine

(2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine (PubChem CID 97087066) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine.

Molecular Properties

Compound Name(2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine
PubChem CID97087066
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name(2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine
SMILESC[C@H](CCc1ccccc1)NC[C@H]1CCCn2ccnc21
InChIInChI=1S/C18H25N3/c1-15(9-10-16-6-3-2-4-7-16)20-14-17-8-5-12-21-13-11-19-18(17)21/h2-4,6-7,11,13,15,17,20H,5,8-10,12,14H2,1H3/t15-,17-/m1/s1
InChIKeyHUHSPNAWPQXJHW-NVXWUHKLSA-N
XLogP3.37
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine with MolForge

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Related Compounds

2-[(4-phenylbutan-2-ylamino)methyl]cyclohexan-1-one
CID 110176147
(2R)-N,N-diethyl-2-phenyl-2-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methylamino]acetamide
CID 97028330
(2R)-N,N-diethyl-2-phenyl-2-[[(8S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methylamino]acetamide
CID 97028328
(2R)-N-(4-methylcyclohexyl)-2-[[(8S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methylamino]propanamide
CID 97091890
2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)-N-(2-thiophen-2-ylethyl)propanamide
CID 71928598
N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine
CID 71929197
(1R)-1-(3-butyl-1,2,4-oxadiazol-5-yl)-N-[[(8S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]ethanamine
CID 97027681
N-[(1-propan-2-ylbenzimidazol-2-yl)methyl]-1-[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methanamine
CID 97019097
(1R)-1-(4-fluorophenyl)-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]propan-1-amine
CID 97025817
(2R)-N-(cyclohexylmethyl)-4-phenylbutan-2-amine
CID 51526703
(1R)-1-(3-chloro-4-fluorophenyl)-N-[[(8S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]ethanamine
CID 97020620
N-(cyclohexylmethyl)-4-phenylbutan-2-amine;hydrochloride
CID 17207144

Frequently Asked Questions

What is the IUPAC name of (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine?
The IUPAC name of (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine (CID 97087066) is (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine.
What is the SMILES notation for (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine?
The canonical SMILES for (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine is C[C@H](CCc1ccccc1)NC[C@H]1CCCn2ccnc21.
What is the InChIKey of (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine?
The InChIKey is HUHSPNAWPQXJHW-NVXWUHKLSA-N. The full InChI is InChI=1S/C18H25N3/c1-15(9-10-16-6-3-2-4-7-16)20-14-17-8-5-12-21-13-11-19-18(17)21/h2-4,6-7,11,13,15,17,20H,5,8-10,12,14H2,1H3/t15-,17-/m1/s1.
What are the key properties of (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine?
(2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine has a molecular weight of 283.42 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-phenyl-N-[[(8R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methyl]butan-2-amine is sourced from PubChem (CID 97087066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).