N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide

C15H29N3O — CID 119591982

IUPACN-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide
SMILESCN1CCC(C(=O)NC(CN)C2CCCCC2)CC1
InChIInChI=1S/C15H29N3O/c1-18-9-7-13(8-10-18)15(19)17-14(11-16)12-5-3-2-4-6-12/h12-14H,2-11,16H2,1H3,(H,17,19)
InChIKeyDBROCGLUXVVQLH-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.35
Rot. Bonds4

About N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide

N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide (PubChem CID 119591982) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide
PubChem CID119591982
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide
SMILESCN1CCC(C(=O)NC(CN)C2CCCCC2)CC1
InChIInChI=1S/C15H29N3O/c1-18-9-7-13(8-10-18)15(19)17-14(11-16)12-5-3-2-4-6-12/h12-14H,2-11,16H2,1H3,(H,17,19)
InChIKeyDBROCGLUXVVQLH-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclohexylethyl)-4-methylcyclohexane-1-carboxamide
CID 81485419
1-acetyl-N-(2-amino-1-cyclohexylethyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119588926
3-N-(2-amino-1-cyclohexylethyl)piperidine-1,3-dicarboxamide;hydrochloride
CID 119591920
N-(2-amino-1-cyclopentylethyl)bicyclo[3.1.0]hexane-3-carboxamide
CID 106737463
N-[4-[(2-amino-1-cyclohexylethyl)amino]-4-oxobutan-2-yl]cyclohexanecarboxamide;hydrochloride
CID 119589615
N-(2-amino-1-cyclohexylethyl)-1-(1,3-benzoxazol-2-yl)piperidine-4-carboxamide
CID 119591481
N-(2-amino-1-cyclohexylethyl)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-4-carboxamide;dihydrochloride
CID 119589919
N-(2-amino-1-cyclohexylethyl)-5-oxopyrrolidine-3-carboxamide
CID 81486792
N-(2-amino-1-cyclohexylethyl)-1-(3,5-dimethylbenzoyl)piperidine-3-carboxamide;hydrochloride
CID 119589481
2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride
CID 119590269
N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethyloxolane-3-carboxamide
CID 115309214
N-(2-amino-1-cyclopropylethyl)-1-propylpyrrolidine-2-carboxamide;dihydrochloride
CID 119612936

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide (CID 119591982) is N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide is CN1CCC(C(=O)NC(CN)C2CCCCC2)CC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide?
The InChIKey is DBROCGLUXVVQLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-18-9-7-13(8-10-18)15(19)17-14(11-16)12-5-3-2-4-6-12/h12-14H,2-11,16H2,1H3,(H,17,19).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide?
N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-1-methylpiperidine-4-carboxamide is sourced from PubChem (CID 119591982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).