N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide

C16H31N3O — CID 83998962

IUPACN-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CCCC(NCC2CCCCC2)C1
InChIInChI=1S/C16H31N3O/c1-14(20)17-9-11-19-10-5-8-16(13-19)18-12-15-6-3-2-4-7-15/h15-16,18H,2-13H2,1H3,(H,17,20)
InChIKeyVPZIOXZWJUYEEJ-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.76
Rot. Bonds6

About N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide

N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide (PubChem CID 83998962) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide
PubChem CID83998962
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CCCC(NCC2CCCCC2)C1
InChIInChI=1S/C16H31N3O/c1-14(20)17-9-11-19-10-5-8-16(13-19)18-12-15-6-3-2-4-7-15/h15-16,18H,2-13H2,1H3,(H,17,20)
InChIKeyVPZIOXZWJUYEEJ-UHFFFAOYSA-N
XLogP1.76
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[3-(cyclopentylmethylamino)piperidin-1-yl]ethyl]acetamide
CID 83998270
N-[2-[3-(cyclopentylmethylamino)-5-ethylpiperidin-1-yl]ethyl]acetamide
CID 83998272
N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide
CID 83997579
methyl 2-[3-(cyclopentylmethylamino)piperidin-1-yl]acetate
CID 83998161
1-(2-acetamidoethyl)piperidine-3-carboxylic acid
CID 43385924
tert-butyl 2-[3-(cyclopentylmethylamino)piperidin-1-yl]acetate
CID 83998176
2-(3-acetamidopiperidin-1-yl)-N-(cyclohexylmethyl)acetamide
CID 75461490
1-(cyclohexylmethyl)-3-[2-[(3S)-3-(hydroxymethyl)piperidin-1-yl]ethyl]urea
CID 164638769
N-[2-(cyclononylamino)ethyl]acetamide
CID 154969023
methyl 3-(cyclopentylmethylamino)piperidine-1-carboxylate
CID 83997762
2-[3-(cyclohexylmethylamino)piperidin-1-yl]acetonitrile
CID 83998870
1-[3-(cyclohexylmethylamino)piperidin-1-yl]-2-methylpropan-1-one
CID 83998592

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide (CID 83998962) is N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide is CC(=O)NCCN1CCCC(NCC2CCCCC2)C1.
What is the InChIKey of N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide?
The InChIKey is VPZIOXZWJUYEEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-14(20)17-9-11-19-10-5-8-16(13-19)18-12-15-6-3-2-4-7-15/h15-16,18H,2-13H2,1H3,(H,17,20).
What are the key properties of N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide?
N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide has a molecular weight of 281.44 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide is sourced from PubChem (CID 83998962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).