2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide

C15H19ClN2O3 — CID 71977415

IUPAC2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide
SMILESCC(NC(=O)CC1CCCO1)(C(N)=O)c1cccc(Cl)c1
InChIInChI=1S/C15H19ClN2O3/c1-15(14(17)20,10-4-2-5-11(16)8-10)18-13(19)9-12-6-3-7-21-12/h2,4-5,8,12H,3,6-7,9H2,1H3,(H2,17,20)(H,18,19)
InChIKeyCLOURIPATSSGDL-UHFFFAOYSA-N
MW310.78 g/mol
LogP1.73
Rot. Bonds5

About 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide

2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide (PubChem CID 71977415) has the molecular formula C15H19ClN2O3 and a molecular weight of 310.78 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide
PubChem CID71977415
Molecular FormulaC15H19ClN2O3
Molecular Weight310.78 g/mol
Exact Mass310.11
IUPAC Name2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide
SMILESCC(NC(=O)CC1CCCO1)(C(N)=O)c1cccc(Cl)c1
InChIInChI=1S/C15H19ClN2O3/c1-15(14(17)20,10-4-2-5-11(16)8-10)18-13(19)9-12-6-3-7-21-12/h2,4-5,8,12H,3,6-7,9H2,1H3,(H2,17,20)(H,18,19)
InChIKeyCLOURIPATSSGDL-UHFFFAOYSA-N
XLogP1.73
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.78
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,5R)-N-[1-amino-2-(3-chlorophenyl)-1-oxopropan-2-yl]-5-(aminomethyl)oxolane-2-carboxamide
CID 120795520
N-(3-chlorophenyl)-2-(oxolan-2-yl)acetamide
CID 47209133
2-(3-chlorophenyl)-1-(oxolan-2-yl)propan-2-amine
CID 62622554
4-amino-N-[1-amino-2-(3-chlorophenyl)-1-oxopropan-2-yl]pentanamide
CID 120563651
N-[1-amino-2-(3-chlorophenyl)-1-oxopropan-2-yl]-4-(methylamino)butanamide
CID 119810304
2-(3-chlorophenyl)-2-[[2-(4-methoxyphenyl)acetyl]amino]propanamide
CID 71862052
(2S)-2-(but-3-enylamino)-2-(3-chlorophenyl)propanamide
CID 97020992
N-(2,6-dichlorophenyl)-2-(oxolan-2-yl)acetamide
CID 110696672
2-amino-N-[1-amino-2-(3-chlorophenyl)-1-oxopropan-2-yl]pentanamide
CID 119338812
N-[(5-chloro-2-methoxyphenyl)methyl]-2-[(2S)-oxolan-2-yl]acetamide
CID 94029080
2-(benzylamino)-2-(3-chlorophenyl)propanamide
CID 60996285
2-(3-chlorophenyl)-2-[[2-(4-methylpiperidin-1-yl)-2-oxoethyl]amino]propanamide
CID 71861458

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide?
The IUPAC name of 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide (CID 71977415) is 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide.
What is the SMILES notation for 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide?
The canonical SMILES for 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide is CC(NC(=O)CC1CCCO1)(C(N)=O)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide?
The InChIKey is CLOURIPATSSGDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O3/c1-15(14(17)20,10-4-2-5-11(16)8-10)18-13(19)9-12-6-3-7-21-12/h2,4-5,8,12H,3,6-7,9H2,1H3,(H2,17,20)(H,18,19).
What are the key properties of 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide?
2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide has a molecular weight of 310.78 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-2-[[2-(oxolan-2-yl)acetyl]amino]propanamide is sourced from PubChem (CID 71977415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).