3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide

C19H25ClN2O3 — CID 108556607

IUPAC3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide
SMILESO=C(CCc1ccc(Cl)cc1)NC1CCN(C(=O)C2CCCO2)CC1
InChIInChI=1S/C19H25ClN2O3/c20-15-6-3-14(4-7-15)5-8-18(23)21-16-9-11-22(12-10-16)19(24)17-2-1-13-25-17/h3-4,6-7,16-17H,1-2,5,8-13H2,(H,21,23)
InChIKeyMIZWWZCFCAJRGE-UHFFFAOYSA-N
MW364.87 g/mol
LogP2.56
Rot. Bonds5

About 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide

3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide (PubChem CID 108556607) has the molecular formula C19H25ClN2O3 and a molecular weight of 364.87 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide
PubChem CID108556607
Molecular FormulaC19H25ClN2O3
Molecular Weight364.87 g/mol
Exact Mass364.16
IUPAC Name3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide
SMILESO=C(CCc1ccc(Cl)cc1)NC1CCN(C(=O)C2CCCO2)CC1
InChIInChI=1S/C19H25ClN2O3/c20-15-6-3-14(4-7-15)5-8-18(23)21-16-9-11-22(12-10-16)19(24)17-2-1-13-25-17/h3-4,6-7,16-17H,1-2,5,8-13H2,(H,21,23)
InChIKeyMIZWWZCFCAJRGE-UHFFFAOYSA-N
XLogP2.56
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.87
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-chlorophenyl)-N-[1-(cyclohexanecarbonyl)piperidin-4-yl]propanamide
CID 108556562
3-(4-chlorophenyl)-N-[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]propanamide
CID 108556549
4-[3-(4-chlorophenyl)propanoylamino]-N,N-dimethylpiperidine-1-carboxamide
CID 108562341
4-(2-chlorophenoxy)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]butanamide
CID 108553687
N-[1-[2-(4-chlorophenyl)acetyl]piperidin-4-yl]oxolane-2-carboxamide
CID 108561805
2-(3,4-dimethoxyphenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]acetamide
CID 108558758
3-(4-chlorophenyl)-N-[1-[4-(4-methylphenyl)-4-oxobutanoyl]piperidin-4-yl]propanamide
CID 108556580
N-[(4-chlorophenyl)methyl]-4-[(2S)-oxolane-2-carbonyl]piperazine-1-carbothioamide
CID 2208369
2-chloro-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]benzamide
CID 110819750
2-(4-chlorophenyl)-N-[1-(cyclopentanecarbonyl)piperidin-4-yl]acetamide
CID 110819967
3-(4-chlorophenyl)-N-[1-(2-fluorobenzoyl)piperidin-4-yl]propanamide
CID 108556555
[1-(oxolane-2-carbonyl)piperidin-4-yl]carbamic acid
CID 156534121

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide (CID 108556607) is 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide is O=C(CCc1ccc(Cl)cc1)NC1CCN(C(=O)C2CCCO2)CC1.
What is the InChIKey of 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide?
The InChIKey is MIZWWZCFCAJRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25ClN2O3/c20-15-6-3-14(4-7-15)5-8-18(23)21-16-9-11-22(12-10-16)19(24)17-2-1-13-25-17/h3-4,6-7,16-17H,1-2,5,8-13H2,(H,21,23).
What are the key properties of 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide?
3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide has a molecular weight of 364.87 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 108556607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).