(3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide

C22H26N4O — CID 126438496

IUPAC(3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide
SMILESCc1cccc([C@H]2CCCN(C(=O)NCc3cn4cccc(C)c4n3)C2)c1
InChIInChI=1S/C22H26N4O/c1-16-6-3-8-18(12-16)19-9-5-11-26(14-19)22(27)23-13-20-15-25-10-4-7-17(2)21(25)24-20/h3-4,6-8,10,12,15,19H,5,9,11,13-14H2,1-2H3,(H,23,27)/t19-/m0/s1
InChIKeyUTOKVYGBKLQBIW-IBGZPJMESA-N
MW362.48 g/mol
LogP4.04
Rot. Bonds3

About (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide

(3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide (PubChem CID 126438496) has the molecular formula C22H26N4O and a molecular weight of 362.48 g/mol. Its IUPAC name is (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide
PubChem CID126438496
Molecular FormulaC22H26N4O
Molecular Weight362.48 g/mol
Exact Mass362.21
IUPAC Name(3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide
SMILESCc1cccc([C@H]2CCCN(C(=O)NCc3cn4cccc(C)c4n3)C2)c1
InChIInChI=1S/C22H26N4O/c1-16-6-3-8-18(12-16)19-9-5-11-26(14-19)22(27)23-13-20-15-25-10-4-7-17(2)21(25)24-20/h3-4,6-8,10,12,15,19H,5,9,11,13-14H2,1-2H3,(H,23,27)/t19-/m0/s1
InChIKeyUTOKVYGBKLQBIW-IBGZPJMESA-N
XLogP4.04
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide?
The IUPAC name of (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide (CID 126438496) is (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide?
The canonical SMILES for (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide is Cc1cccc([C@H]2CCCN(C(=O)NCc3cn4cccc(C)c4n3)C2)c1.
What is the InChIKey of (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide?
The InChIKey is UTOKVYGBKLQBIW-IBGZPJMESA-N. The full InChI is InChI=1S/C22H26N4O/c1-16-6-3-8-18(12-16)19-9-5-11-26(14-19)22(27)23-13-20-15-25-10-4-7-17(2)21(25)24-20/h3-4,6-8,10,12,15,19H,5,9,11,13-14H2,1-2H3,(H,23,27)/t19-/m0/s1.
What are the key properties of (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide?
(3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide has a molecular weight of 362.48 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 126438496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).