2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide

C22H24N4O3 — CID 95861441

IUPAC2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide
SMILESO=C(C[C@H]1COCCN1C(=O)CCc1cn2ccccc2n1)Nc1ccccc1
InChIInChI=1S/C22H24N4O3/c27-21(24-17-6-2-1-3-7-17)14-19-16-29-13-12-26(19)22(28)10-9-18-15-25-11-5-4-8-20(25)23-18/h1-8,11,15,19H,9-10,12-14,16H2,(H,24,27)/t19-/m0/s1
InChIKeyCPSISXFWAKQGCD-IBGZPJMESA-N
MW392.46 g/mol
LogP2.52
Rot. Bonds6

About 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide

2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide (PubChem CID 95861441) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide
PubChem CID95861441
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC Name2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide
SMILESO=C(C[C@H]1COCCN1C(=O)CCc1cn2ccccc2n1)Nc1ccccc1
InChIInChI=1S/C22H24N4O3/c27-21(24-17-6-2-1-3-7-17)14-19-16-29-13-12-26(19)22(28)10-9-18-15-25-11-5-4-8-20(25)23-18/h1-8,11,15,19H,9-10,12-14,16H2,(H,24,27)/t19-/m0/s1
InChIKeyCPSISXFWAKQGCD-IBGZPJMESA-N
XLogP2.52
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3R)-4-[2-(2-amino-4,6-dimethylpyrimidin-5-yl)acetyl]morpholin-3-yl]-N-phenylacetamide
CID 95863044
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-morpholin-4-ylbenzamide
CID 131948507
3-imidazo[1,2-a]pyridin-2-yl-N-[(3S,4R)-3-(3-methylbut-2-enoxy)oxan-4-yl]propanamide
CID 91794310
(3S)-4-(cyclobutylmethyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)morpholine-3-carboxamide
CID 124619070
2-[(3S)-4-(1-ethyl-2,5-dimethylpyrrole-3-carbonyl)morpholin-3-yl]-N-phenylacetamide
CID 95889150
3-imidazo[1,2-a]pyridin-2-yl-1-[2-(5-propan-2-yl-1,2-oxazol-3-yl)pyrrolidin-1-yl]propan-1-one
CID 50959448
3-imidazo[1,2-a]pyridin-2-yl-1-[(2R)-4-(4-methoxyphenyl)-2-methylpiperazin-1-yl]propan-1-one
CID 95889414
1-[3-(2-hydroxyethyl)-4-methylpiperazin-1-yl]-3-imidazo[1,2-a]pyridin-2-ylpropan-1-one
CID 70722103
2-[(3R)-4-(1-ethylpyrazol-4-yl)sulfonylmorpholin-3-yl]-N-phenylacetamide
CID 95867516
2-[(3S)-4-(3-pyridin-3-ylpropanoyl)morpholin-3-yl]acetic acid
CID 99625562
[(3S,4S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methylpyrrolidin-3-yl]-morpholin-4-ylmethanone
CID 154793507
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 60672705

Frequently Asked Questions

What is the IUPAC name of 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide?
The IUPAC name of 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide (CID 95861441) is 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide?
The canonical SMILES for 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide is O=C(C[C@H]1COCCN1C(=O)CCc1cn2ccccc2n1)Nc1ccccc1.
What is the InChIKey of 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide?
The InChIKey is CPSISXFWAKQGCD-IBGZPJMESA-N. The full InChI is InChI=1S/C22H24N4O3/c27-21(24-17-6-2-1-3-7-17)14-19-16-29-13-12-26(19)22(28)10-9-18-15-25-11-5-4-8-20(25)23-18/h1-8,11,15,19H,9-10,12-14,16H2,(H,24,27)/t19-/m0/s1.
What are the key properties of 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide?
2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide has a molecular weight of 392.46 g/mol, XLogP of 2.52, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3S)-4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)morpholin-3-yl]-N-phenylacetamide is sourced from PubChem (CID 95861441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).