2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride

C16H31ClN2O — CID 120573985

IUPAC2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride
SMILESCCC(CC1CCCC1)C(=O)NC1CCCNC1C.Cl
InChIInChI=1S/C16H30N2O.ClH/c1-3-14(11-13-7-4-5-8-13)16(19)18-15-9-6-10-17-12(15)2;/h12-15,17H,3-11H2,1-2H3,(H,18,19);1H
InChIKeyOUOLIEODACAKEC-UHFFFAOYSA-N
MW302.89 g/mol
LogP3.27
Rot. Bonds5

About 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride

2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride (PubChem CID 120573985) has the molecular formula C16H31ClN2O and a molecular weight of 302.89 g/mol. Its IUPAC name is 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride
PubChem CID120573985
Molecular FormulaC16H31ClN2O
Molecular Weight302.89 g/mol
Exact Mass302.21
IUPAC Name2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride
SMILESCCC(CC1CCCC1)C(=O)NC1CCCNC1C.Cl
InChIInChI=1S/C16H30N2O.ClH/c1-3-14(11-13-7-4-5-8-13)16(19)18-15-9-6-10-17-12(15)2;/h12-15,17H,3-11H2,1-2H3,(H,18,19);1H
InChIKeyOUOLIEODACAKEC-UHFFFAOYSA-N
XLogP3.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.89
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(2R,3R)-2-methylpiperidin-3-yl]butanamide
CID 130763419
(2R)-2-amino-N-(2-methylpiperidin-3-yl)butanamide
CID 130921760
2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)butanamide
CID 120553439
2-(cyclopentylmethyl)-N-(pyrrolidin-2-ylmethyl)butanamide;hydrochloride
CID 119510206
2-(cyclohexylmethyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119450514
2-(cyclopentylmethyl)-N-pyrrolidin-3-ylbutanamide
CID 119449890
2-(cyclopentylmethyl)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 119510207
2-acetamido-2-cyclopentyl-N-(2-methylpiperidin-3-yl)acetamide
CID 120577799
3-methyl-2-(3-methylbutanoylamino)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride
CID 120577673
N-(2-methylpiperidin-3-yl)-2-methylsulfanylpropanamide
CID 120576561
2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
CID 119555362
2-cycloheptyloxy-N-(2-methylpiperidin-3-yl)propanamide
CID 120576393

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride?
The IUPAC name of 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride (CID 120573985) is 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride.
What is the SMILES notation for 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride?
The canonical SMILES for 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride is CCC(CC1CCCC1)C(=O)NC1CCCNC1C.Cl.
What is the InChIKey of 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride?
The InChIKey is OUOLIEODACAKEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O.ClH/c1-3-14(11-13-7-4-5-8-13)16(19)18-15-9-6-10-17-12(15)2;/h12-15,17H,3-11H2,1-2H3,(H,18,19);1H.
What are the key properties of 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride?
2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride has a molecular weight of 302.89 g/mol, XLogP of 3.27, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride is sourced from PubChem (CID 120573985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).