2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide

C14H27N3O — CID 83998206

IUPAC2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide
SMILESCC1CC(NCC2CCCC2)CN(CC(N)=O)C1
InChIInChI=1S/C14H27N3O/c1-11-6-13(9-17(8-11)10-14(15)18)16-7-12-4-2-3-5-12/h11-13,16H,2-10H2,1H3,(H2,15,18)
InChIKeyNWCDGCBNEXHOKX-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.96
Rot. Bonds5

About 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide

2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide (PubChem CID 83998206) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide
PubChem CID83998206
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide
SMILESCC1CC(NCC2CCCC2)CN(CC(N)=O)C1
InChIInChI=1S/C14H27N3O/c1-11-6-13(9-17(8-11)10-14(15)18)16-7-12-4-2-3-5-12/h11-13,16H,2-10H2,1H3,(H2,15,18)
InChIKeyNWCDGCBNEXHOKX-UHFFFAOYSA-N
XLogP0.96
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetate
CID 83998177
2-[3-(cyclopentylmethylamino)-5-(3-hydroxypropyl)piperidin-1-yl]acetamide
CID 83998219
3-(cyclobutylmethylamino)-5-methylpiperidine-1-carboxamide
CID 83997098
N-(cyclopentylmethyl)-5-methyl-1-(2-methylpropyl)piperidin-3-amine
CID 83997686
N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide
CID 83997579
N-[1-(2-amino-2-oxoethyl)-5-methylpiperidin-3-yl]-2,2-dimethylpropanamide
CID 112542492
3-[1-(2-amino-2-oxoethyl)-5-(cyclopropylmethylamino)piperidin-3-yl]propanoic acid
CID 83996834
2-[3-(cyclopentylmethylamino)-5-propan-2-ylpiperidin-1-yl]acetic acid
CID 83998151
methyl 2-[3-(cyclohexylmethylamino)-5-(cyclopropylmethyl)piperidin-1-yl]acetate
CID 83998859
1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
CID 83997328
methyl 2-[1-(2-amino-2-oxoethyl)-5-(cyclohexylamino)piperidin-3-yl]acetate
CID 83999600
2-[3-(cyclobutylmethylamino)-5-(2,2-dimethylpropyl)piperidin-1-yl]acetic acid
CID 83997461

Frequently Asked Questions

What is the IUPAC name of 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide?
The IUPAC name of 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide (CID 83998206) is 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide.
What is the SMILES notation for 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide?
The canonical SMILES for 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide is CC1CC(NCC2CCCC2)CN(CC(N)=O)C1.
What is the InChIKey of 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide?
The InChIKey is NWCDGCBNEXHOKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-11-6-13(9-17(8-11)10-14(15)18)16-7-12-4-2-3-5-12/h11-13,16H,2-10H2,1H3,(H2,15,18).
What are the key properties of 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide?
2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide has a molecular weight of 253.39 g/mol, XLogP of 0.96, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide is sourced from PubChem (CID 83998206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).