N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide

C14H27N3O — CID 120704864

IUPACN-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide
SMILESCNCC(=O)NC1CCN(C2CCCCC2)CC1
InChIInChI=1S/C14H27N3O/c1-15-11-14(18)16-12-7-9-17(10-8-12)13-5-3-2-4-6-13/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyLQXNNHHCQGLRKO-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.12
Rot. Bonds4

About N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide

N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide (PubChem CID 120704864) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide
PubChem CID120704864
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide
SMILESCNCC(=O)NC1CCN(C2CCCCC2)CC1
InChIInChI=1S/C14H27N3O/c1-15-11-14(18)16-12-7-9-17(10-8-12)13-5-3-2-4-6-13/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyLQXNNHHCQGLRKO-UHFFFAOYSA-N
XLogP1.12
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclopentylpiperidin-4-yl)-2-(2-methoxyethylamino)acetamide
CID 119846699
N-[2-(cyclohexylamino)-2-oxoethyl]-2-(methylamino)acetamide;hydrochloride
CID 119759466
N-(1-cyclopropylpiperidin-4-yl)-2-(propylamino)acetamide
CID 60720397
2-chloro-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 43424767
4-amino-N-(1-cyclopentylpiperidin-4-yl)butanamide;dihydrochloride
CID 119846701
2-(methylamino)-N-[1-(2-methylpropyl)piperidin-4-yl]acetamide;dihydrochloride
CID 119841092
(2R)-2-amino-N-(1-cyclopentylpiperidin-4-yl)propanamide
CID 119846668
tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate
CID 53255880
2-(methylamino)-N-(4-methylcyclohexyl)acetamide
CID 24706829
N-(1-cyclopropylpiperidin-4-yl)-2-ethoxyacetamide
CID 60730874
N-[1-(oxetan-3-yl)piperidin-4-yl]propanamide
CID 170412033
N-(1-cyclopropylpiperidin-4-yl)cyclopentanecarboxamide
CID 110750777

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide?
The IUPAC name of N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide (CID 120704864) is N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide.
What is the SMILES notation for N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide?
The canonical SMILES for N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide is CNCC(=O)NC1CCN(C2CCCCC2)CC1.
What is the InChIKey of N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide?
The InChIKey is LQXNNHHCQGLRKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-15-11-14(18)16-12-7-9-17(10-8-12)13-5-3-2-4-6-13/h12-13,15H,2-11H2,1H3,(H,16,18).
What are the key properties of N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide?
N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide has a molecular weight of 253.39 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide is sourced from PubChem (CID 120704864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).