2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride

C18H35ClN2O — CID 120556998

IUPAC2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride
SMILESCCCC(CC1CCCCC1)C(=O)NC1CCNCC1C.Cl
InChIInChI=1S/C18H34N2O.ClH/c1-3-7-16(12-15-8-5-4-6-9-15)18(21)20-17-10-11-19-13-14(17)2;/h14-17,19H,3-13H2,1-2H3,(H,20,21);1H
InChIKeyUAZYFWSGVHPXKD-UHFFFAOYSA-N
MW330.94 g/mol
LogP3.91
Rot. Bonds6

About 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride

2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride (PubChem CID 120556998) has the molecular formula C18H35ClN2O and a molecular weight of 330.94 g/mol. Its IUPAC name is 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride
PubChem CID120556998
Molecular FormulaC18H35ClN2O
Molecular Weight330.94 g/mol
Exact Mass330.24
IUPAC Name2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride
SMILESCCCC(CC1CCCCC1)C(=O)NC1CCNCC1C.Cl
InChIInChI=1S/C18H34N2O.ClH/c1-3-7-16(12-15-8-5-4-6-9-15)18(21)20-17-10-11-19-13-14(17)2;/h14-17,19H,3-13H2,1-2H3,(H,20,21);1H
InChIKeyUAZYFWSGVHPXKD-UHFFFAOYSA-N
XLogP3.91
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.94
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)butanamide
CID 120553439
2-(cyclohexylmethyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119450514
N-(3-methylpiperidin-4-yl)-2-prop-2-enylpent-4-enamide;hydrochloride
CID 120553440
2-(cyclopentylmethyl)-N-pyrrolidin-3-ylbutanamide
CID 119449890
2-cyclohexyloxy-N-(3-methylpiperidin-4-yl)butanamide;hydrochloride
CID 120557800
2-acetamido-2-cyclopentyl-N-(3-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120556382
N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride
CID 120557474
N-(3-methylpiperidin-4-yl)-2-phenylpentanamide
CID 120556814
2-(azepan-1-yl)-N-(3-methylpiperidin-4-yl)propanamide;dihydrochloride
CID 120557148
2-butoxy-N-(3-methylpiperidin-4-yl)propanamide
CID 120553227
2-(cyclopentylmethyl)-N-(2-methylpiperidin-3-yl)butanamide;hydrochloride
CID 120573985
2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide
CID 120555425

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride?
The IUPAC name of 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride (CID 120556998) is 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride.
What is the SMILES notation for 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride?
The canonical SMILES for 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride is CCCC(CC1CCCCC1)C(=O)NC1CCNCC1C.Cl.
What is the InChIKey of 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride?
The InChIKey is UAZYFWSGVHPXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O.ClH/c1-3-7-16(12-15-8-5-4-6-9-15)18(21)20-17-10-11-19-13-14(17)2;/h14-17,19H,3-13H2,1-2H3,(H,20,21);1H.
What are the key properties of 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride?
2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride has a molecular weight of 330.94 g/mol, XLogP of 3.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride is sourced from PubChem (CID 120556998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).