1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone

C16H30N2O — CID 104750584

IUPAC1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone
SMILESCCCN(CC(=O)C1CCCCC1)C1CCNCC1
InChIInChI=1S/C16H30N2O/c1-2-12-18(15-8-10-17-11-9-15)13-16(19)14-6-4-3-5-7-14/h14-15,17H,2-13H2,1H3
InChIKeyLMKIZALVOQQQCK-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.60
Rot. Bonds6

About 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone

1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone (PubChem CID 104750584) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone.

Molecular Properties

Compound Name1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone
PubChem CID104750584
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone
SMILESCCCN(CC(=O)C1CCCCC1)C1CCNCC1
InChIInChI=1S/C16H30N2O/c1-2-12-18(15-8-10-17-11-9-15)13-16(19)14-6-4-3-5-7-14/h14-15,17H,2-13H2,1H3
InChIKeyLMKIZALVOQQQCK-UHFFFAOYSA-N
XLogP2.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119933007
1-[piperidin-4-yl(propyl)amino]pentan-2-one
CID 62044449
2-[piperidin-4-yl(propyl)amino]-N,N-dipropylacetamide
CID 60805133
1-cyclohexyl-2-[cyclopentyl(ethyl)amino]ethanone
CID 104750031
3,3-dimethyl-1-[piperidin-4-yl(propyl)amino]butan-2-one
CID 62030880
N-cyclopropyl-N-methyl-2-[piperidin-4-yl(propyl)amino]acetamide
CID 54957401
N-ethyl-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60807335
2-[cyclododecyl(propyl)amino]acetic acid
CID 65064979
N-(cyclopropylmethyl)-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60806815
1-cyclopentyl-2-[methyl(propyl)amino]ethanone
CID 104750008
N-ethyl-N-phenyl-2-[piperidin-4-yl(propyl)amino]acetamide
CID 119932706
N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119933013

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone?
The IUPAC name of 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone (CID 104750584) is 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone.
What is the SMILES notation for 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone?
The canonical SMILES for 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone is CCCN(CC(=O)C1CCCCC1)C1CCNCC1.
What is the InChIKey of 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone?
The InChIKey is LMKIZALVOQQQCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-12-18(15-8-10-17-11-9-15)13-16(19)14-6-4-3-5-7-14/h14-15,17H,2-13H2,1H3.
What are the key properties of 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone?
1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone has a molecular weight of 266.43 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone is sourced from PubChem (CID 104750584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).