3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride

C17H27ClN2O — CID 75418755

IUPAC3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride
SMILESCCCc1ccccc1NC(=O)CCC1CCNCC1.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-2-5-15-6-3-4-7-16(15)19-17(20)9-8-14-10-12-18-13-11-14;/h3-4,6-7,14,18H,2,5,8-13H2,1H3,(H,19,20);1H
InChIKeyVFEYVDHDVCQRBL-UHFFFAOYSA-N
MW310.87 g/mol
LogP3.78
Rot. Bonds6

About 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride

3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride (PubChem CID 75418755) has the molecular formula C17H27ClN2O and a molecular weight of 310.87 g/mol. Its IUPAC name is 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride
PubChem CID75418755
Molecular FormulaC17H27ClN2O
Molecular Weight310.87 g/mol
Exact Mass310.18
IUPAC Name3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride
SMILESCCCc1ccccc1NC(=O)CCC1CCNCC1.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-2-5-15-6-3-4-7-16(15)19-17(20)9-8-14-10-12-18-13-11-14;/h3-4,6-7,14,18H,2,5,8-13H2,1H3,(H,19,20);1H
InChIKeyVFEYVDHDVCQRBL-UHFFFAOYSA-N
XLogP3.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.87
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(4-bromo-2-ethylphenyl)-3-piperidin-4-ylpropanamide
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3-[2-(3-cyclopentylpropanoylamino)phenyl]propanoic acid
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3-cyclopentyl-N-[2-(methylaminomethyl)phenyl]propanamide;hydrochloride
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3-cyclopentyl-N-[2-(hydroxymethyl)phenyl]propanamide
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4-amino-N-(2-propylphenyl)pentanamide;hydrochloride
CID 120559764
ethane;N-(2-propylphenyl)acetamide
CID 142804217
N-(2-propylphenyl)piperidin-4-amine
CID 61016872
N-(2-acetamidophenyl)-3-cyclopentylpropanamide
CID 976246
2-methyl-2-piperazin-1-yl-N-(2-propylphenyl)propanamide
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N-(2,4-dichlorophenyl)-3-piperidin-4-ylpropanamide
CID 62210490

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride?
The IUPAC name of 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride (CID 75418755) is 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride.
What is the SMILES notation for 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride?
The canonical SMILES for 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride is CCCc1ccccc1NC(=O)CCC1CCNCC1.Cl.
What is the InChIKey of 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride?
The InChIKey is VFEYVDHDVCQRBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O.ClH/c1-2-5-15-6-3-4-7-16(15)19-17(20)9-8-14-10-12-18-13-11-14;/h3-4,6-7,14,18H,2,5,8-13H2,1H3,(H,19,20);1H.
What are the key properties of 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride?
3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride has a molecular weight of 310.87 g/mol, XLogP of 3.78, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-N-(2-propylphenyl)propanamide;hydrochloride is sourced from PubChem (CID 75418755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).