N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide

C16H22N4O2 — CID 94800160

IUPACN-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCC[C@H](C)NC(=O)CCNC(=O)c1cn2c(C)cccc2n1
InChIInChI=1S/C16H22N4O2/c1-4-11(2)18-15(21)8-9-17-16(22)13-10-20-12(3)6-5-7-14(20)19-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,17,22)(H,18,21)/t11-/m0/s1
InChIKeyHPRYNTFWCZSSMV-NSHDSACASA-N
MW302.38 g/mol
LogP1.68
Rot. Bonds6

About N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide

N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 94800160) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID94800160
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC NameN-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCC[C@H](C)NC(=O)CCNC(=O)c1cn2c(C)cccc2n1
InChIInChI=1S/C16H22N4O2/c1-4-11(2)18-15(21)8-9-17-16(22)13-10-20-12(3)6-5-7-14(20)19-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,17,22)(H,18,21)/t11-/m0/s1
InChIKeyHPRYNTFWCZSSMV-NSHDSACASA-N
XLogP1.68
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide with MolForge

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Related Compounds

6-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]hexanoic acid
CID 39186729
N-(1-hydroxybutan-2-yl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 43417880
N-[3-(butan-2-ylamino)-3-oxopropyl]-3-methylbenzamide
CID 17191435
methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate
CID 43408753
N-[3-(butan-2-ylamino)-3-oxopropyl]-6-(ethylamino)pyridazine-3-carboxamide
CID 62177406
N-[3-(butan-2-ylamino)-3-oxopropyl]-2,3-dihydroxybenzamide
CID 114344226
N-[3-(butan-2-ylamino)-3-oxopropyl]-2-fluoro-3-methylbenzamide
CID 80718445
3-amino-N-[3-(butan-2-ylamino)-3-oxopropyl]-2-methylbenzamide
CID 61140590
N-(5-hydroxy-2,2-dimethylpentyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 103900041
N-(1-hydroxy-3-methylpentan-3-yl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 103945561
6-[[3-(butan-2-ylamino)-3-oxopropyl]amino]pyridine-2-carboxylic acid
CID 62238876
1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 81369818

Frequently Asked Questions

What is the IUPAC name of N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 94800160) is N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide is CC[C@H](C)NC(=O)CCNC(=O)c1cn2c(C)cccc2n1.
What is the InChIKey of N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is HPRYNTFWCZSSMV-NSHDSACASA-N. The full InChI is InChI=1S/C16H22N4O2/c1-4-11(2)18-15(21)8-9-17-16(22)13-10-20-12(3)6-5-7-14(20)19-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,17,22)(H,18,21)/t11-/m0/s1.
What are the key properties of N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 94800160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).