(4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide

C15H21N5O2 — CID 125439427

IUPAC(4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
SMILESCC(C)Cc1cc(CNC(=O)[C@@H]2NCCc3[nH]cnc32)on1
InChIInChI=1S/C15H21N5O2/c1-9(2)5-10-6-11(22-20-10)7-17-15(21)14-13-12(3-4-16-14)18-8-19-13/h6,8-9,14,16H,3-5,7H2,1-2H3,(H,17,21)(H,18,19)/t14-/m1/s1
InChIKeyUXUUNUXQCAEQQS-CQSZACIVSA-N
MW303.37 g/mol
LogP1.10
Rot. Bonds5

About (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide

(4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide (PubChem CID 125439427) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name(4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
PubChem CID125439427
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name(4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
SMILESCC(C)Cc1cc(CNC(=O)[C@@H]2NCCc3[nH]cnc32)on1
InChIInChI=1S/C15H21N5O2/c1-9(2)5-10-6-11(22-20-10)7-17-15(21)14-13-12(3-4-16-14)18-8-19-13/h6,8-9,14,16H,3-5,7H2,1-2H3,(H,17,21)(H,18,19)/t14-/m1/s1
InChIKeyUXUUNUXQCAEQQS-CQSZACIVSA-N
XLogP1.10
TPSA95.84 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide with MolForge

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Related Compounds

(4S)-N-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 95885150
N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 70724211
(4S)-N-(3,3-diphenylpropyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 125445481
(4R)-N-(2-phenoxyethyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 95893769
(4R)-N-(3-cyclohexyloxypropyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 95868430
(4S)-N-[(4-oxo-3H-phthalazin-1-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 95862076
(4S)-N-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 95873248
(4S)-N-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 95872075
ethyl (4R)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxylate
CID 124518603
(4S)-N-[3-(4,5-dimethyl-1,3-thiazol-2-yl)propyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 95871408
N-[2-(2H-triazol-4-ylsulfanyl)ethyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 70769656
N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-2-oxo-1-oxaspiro[4.4]nonane-4-carboxamide
CID 131907170

Frequently Asked Questions

What is the IUPAC name of (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide?
The IUPAC name of (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide (CID 125439427) is (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide.
What is the SMILES notation for (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide?
The canonical SMILES for (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide is CC(C)Cc1cc(CNC(=O)[C@@H]2NCCc3[nH]cnc32)on1.
What is the InChIKey of (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide?
The InChIKey is UXUUNUXQCAEQQS-CQSZACIVSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-9(2)5-10-6-11(22-20-10)7-17-15(21)14-13-12(3-4-16-14)18-8-19-13/h6,8-9,14,16H,3-5,7H2,1-2H3,(H,17,21)(H,18,19)/t14-/m1/s1.
What are the key properties of (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide?
(4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 1.10, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide is sourced from PubChem (CID 125439427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).