2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride

C17H33ClN2O — CID 119555362

IUPAC2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
SMILESCCC(CC1CCCC1)C(=O)NCCC1CCCNC1.Cl
InChIInChI=1S/C17H32N2O.ClH/c1-2-16(12-14-6-3-4-7-14)17(20)19-11-9-15-8-5-10-18-13-15;/h14-16,18H,2-13H2,1H3,(H,19,20);1H
InChIKeyKTHRUULCOORDOW-UHFFFAOYSA-N
MW316.92 g/mol
LogP3.52
Rot. Bonds7

About 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride

2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride (PubChem CID 119555362) has the molecular formula C17H33ClN2O and a molecular weight of 316.92 g/mol. Its IUPAC name is 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
PubChem CID119555362
Molecular FormulaC17H33ClN2O
Molecular Weight316.92 g/mol
Exact Mass316.23
IUPAC Name2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
SMILESCCC(CC1CCCC1)C(=O)NCCC1CCCNC1.Cl
InChIInChI=1S/C17H32N2O.ClH/c1-2-16(12-14-6-3-4-7-14)17(20)19-11-9-15-8-5-10-18-13-15;/h14-16,18H,2-13H2,1H3,(H,19,20);1H
InChIKeyKTHRUULCOORDOW-UHFFFAOYSA-N
XLogP3.52
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.92
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide
CID 119460240
2-ethyl-N-(2-pyrrolidin-3-ylethyl)butanamide
CID 63624155
2-ethyl-N-(piperidin-3-ylmethyl)butanamide;hydrochloride
CID 119462909
2,3-dimethyl-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
CID 119555477
2-(cyclohexylmethyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119450514
2-(cyclopentylmethyl)-N-pyrrolidin-3-ylbutanamide
CID 119449890
2-acetamido-2-cyclopentyl-N-(2-piperidin-3-ylethyl)acetamide
CID 119555580
2-(cyclopentylmethyl)-N-(pyrrolidin-2-ylmethyl)butanamide;hydrochloride
CID 119510206
2-(cyclohexylmethyl)-N-[2-(methylamino)ethyl]butanamide;hydrochloride
CID 119500875
2-cyclohexyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119260693
2-cycloheptyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119557821
2-(cyclopentylmethyl)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 119510207

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride?
The IUPAC name of 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride (CID 119555362) is 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride.
What is the SMILES notation for 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride?
The canonical SMILES for 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride is CCC(CC1CCCC1)C(=O)NCCC1CCCNC1.Cl.
What is the InChIKey of 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride?
The InChIKey is KTHRUULCOORDOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O.ClH/c1-2-16(12-14-6-3-4-7-14)17(20)19-11-9-15-8-5-10-18-13-15;/h14-16,18H,2-13H2,1H3,(H,19,20);1H.
What are the key properties of 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride?
2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride has a molecular weight of 316.92 g/mol, XLogP of 3.52, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride is sourced from PubChem (CID 119555362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).