4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide

C21H24N4O3 — CID 27861009

IUPAC4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
SMILESCCCNC(=O)[C@H](C)NC(=O)c1ccc(OCc2cn3ccccc3n2)cc1
InChIInChI=1S/C21H24N4O3/c1-3-11-22-20(26)15(2)23-21(27)16-7-9-18(10-8-16)28-14-17-13-25-12-5-4-6-19(25)24-17/h4-10,12-13,15H,3,11,14H2,1-2H3,(H,22,26)(H,23,27)/t15-/m0/s1
InChIKeyHMKLACVMKXLODH-HNNXBMFYSA-N
MW380.45 g/mol
LogP2.56
Rot. Bonds8

About 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide

4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide (PubChem CID 27861009) has the molecular formula C21H24N4O3 and a molecular weight of 380.45 g/mol. Its IUPAC name is 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide.

Molecular Properties

Compound Name4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
PubChem CID27861009
Molecular FormulaC21H24N4O3
Molecular Weight380.45 g/mol
Exact Mass380.18
IUPAC Name4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
SMILESCCCNC(=O)[C@H](C)NC(=O)c1ccc(OCc2cn3ccccc3n2)cc1
InChIInChI=1S/C21H24N4O3/c1-3-11-22-20(26)15(2)23-21(27)16-7-9-18(10-8-16)28-14-17-13-25-12-5-4-6-19(25)24-17/h4-10,12-13,15H,3,11,14H2,1-2H3,(H,22,26)(H,23,27)/t15-/m0/s1
InChIKeyHMKLACVMKXLODH-HNNXBMFYSA-N
XLogP2.56
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[4-(imidazo[1,2-a]pyridin-2-ylmethoxy)anilino]-3-methyl-1-oxobutan-2-yl]benzamide
CID 86894155
2-(imidazo[1,2-a]pyridin-2-ylmethylamino)-N-propylpropanamide
CID 60676900
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide
CID 9400053
N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 40920170
N-(3,5-difluorophenyl)-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 25406496
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1R,2R)-2-methylcyclohexyl]benzamide
CID 40723884
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-4-methoxybutan-2-yl]benzamide
CID 52843285
(2S)-2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]-3-methylbutanoic acid
CID 119360221
N-[(3S)-1,1-dioxothiolan-3-yl]-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 27710930
N-[(3-chlorophenyl)methyl]-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 9402179
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-pentylbenzamide
CID 134009641
4-ethoxy-N-[2-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-2-oxoethyl]benzamide
CID 25429958

Frequently Asked Questions

What is the IUPAC name of 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide?
The IUPAC name of 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide (CID 27861009) is 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide.
What is the SMILES notation for 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide?
The canonical SMILES for 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide is CCCNC(=O)[C@H](C)NC(=O)c1ccc(OCc2cn3ccccc3n2)cc1.
What is the InChIKey of 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide?
The InChIKey is HMKLACVMKXLODH-HNNXBMFYSA-N. The full InChI is InChI=1S/C21H24N4O3/c1-3-11-22-20(26)15(2)23-21(27)16-7-9-18(10-8-16)28-14-17-13-25-12-5-4-6-19(25)24-17/h4-10,12-13,15H,3,11,14H2,1-2H3,(H,22,26)(H,23,27)/t15-/m0/s1.
What are the key properties of 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide?
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide has a molecular weight of 380.45 g/mol, XLogP of 2.56, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide is sourced from PubChem (CID 27861009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).