N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane

C23H34N4O2 — CID 143685607

IUPACN-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane
SMILESCC(C)C1CCCCC1.CNC(=O)c1cccc2nc(C(=O)N3CC(C)C3)cn12
InChIInChI=1S/C14H16N4O2.C9H18/c1-9-6-17(7-9)14(20)10-8-18-11(13(19)15-2)4-3-5-12(18)16-10;1-8(2)9-6-4-3-5-7-9/h3-5,8-9H,6-7H2,1-2H3,(H,15,19);8-9H,3-7H2,1-2H3
InChIKeySVOSDHVWSJUOSC-UHFFFAOYSA-N
MW398.55 g/mol
LogP4.01
Rot. Bonds3

About N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane

N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane (PubChem CID 143685607) has the molecular formula C23H34N4O2 and a molecular weight of 398.55 g/mol. Its IUPAC name is N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane.

Molecular Properties

Compound NameN-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane
PubChem CID143685607
Molecular FormulaC23H34N4O2
Molecular Weight398.55 g/mol
Exact Mass398.27
IUPAC NameN-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane
SMILESCC(C)C1CCCCC1.CNC(=O)c1cccc2nc(C(=O)N3CC(C)C3)cn12
InChIInChI=1S/C14H16N4O2.C9H18/c1-9-6-17(7-9)14(20)10-8-18-11(13(19)15-2)4-3-5-12(18)16-10;1-8(2)9-6-4-3-5-7-9/h3-5,8-9H,6-7H2,1-2H3,(H,15,19);8-9H,3-7H2,1-2H3
InChIKeySVOSDHVWSJUOSC-UHFFFAOYSA-N
XLogP4.01
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.55
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminopyrrolidine-1-carbonyl)-N-methylimidazo[1,2-a]pyridine-5-carboxamide
CID 143685907
2-[2-(aminomethyl)pyrrolidine-1-carbonyl]-N-methylimidazo[1,2-a]pyridine-5-carboxamide
CID 143685983
N-methyl-6-(3-propan-2-ylazetidine-1-carbonyl)pyridine-2-carboxamide
CID 177348900
ethane;N-methyl-6-(3-propan-2-ylazetidine-1-carbonyl)pyridine-2-carboxamide
CID 177348899
(4-methylazepan-1-yl)-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 56821890
2-[2-(3-aminopiperidin-1-yl)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-5-carboxamide
CID 143685923
1-(5-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 63030760
2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide
CID 70862354
2-[(3R)-3-aminopyrrolidine-1-carbonyl]-N-(4-methyl-2-pyridin-3-ylpentyl)imidazo[1,2-a]pyridine-5-carboxamide
CID 70862485
2-[(cyclobutylamino)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117255785
(3-methylpyrrolidin-1-yl)-[6-(propan-2-ylamino)-2-pyridinyl]methanone
CID 115498253
[2-(hydroxymethyl)azepan-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 116636500

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane?
The IUPAC name of N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane (CID 143685607) is N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane.
What is the SMILES notation for N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane?
The canonical SMILES for N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane is CC(C)C1CCCCC1.CNC(=O)c1cccc2nc(C(=O)N3CC(C)C3)cn12.
What is the InChIKey of N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane?
The InChIKey is SVOSDHVWSJUOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2.C9H18/c1-9-6-17(7-9)14(20)10-8-18-11(13(19)15-2)4-3-5-12(18)16-10;1-8(2)9-6-4-3-5-7-9/h3-5,8-9H,6-7H2,1-2H3,(H,15,19);8-9H,3-7H2,1-2H3.
What are the key properties of N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane?
N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane has a molecular weight of 398.55 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane is sourced from PubChem (CID 143685607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).