3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide

C14H27N3O — CID 83997100

IUPAC3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide
SMILESCCCC1CC(NCC2CCC2)CN(C(N)=O)C1
InChIInChI=1S/C14H27N3O/c1-2-4-12-7-13(10-17(9-12)14(15)18)16-8-11-5-3-6-11/h11-13,16H,2-10H2,1H3,(H2,15,18)
InChIKeyACNCAKMZHWNDSI-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.95
Rot. Bonds5

About 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide

3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide (PubChem CID 83997100) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide
PubChem CID83997100
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide
SMILESCCCC1CC(NCC2CCC2)CN(C(N)=O)C1
InChIInChI=1S/C14H27N3O/c1-2-4-12-7-13(10-17(9-12)14(15)18)16-8-11-5-3-6-11/h11-13,16H,2-10H2,1H3,(H2,15,18)
InChIKeyACNCAKMZHWNDSI-UHFFFAOYSA-N
XLogP1.95
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(cyclobutylmethylamino)-5-(2,2-dimethylpropyl)piperidine-1-carboxamide
CID 83997104
methyl 3-(cyclopentylmethylamino)-5-propylpiperidine-1-carboxylate
CID 83997765
1-[3-(cyclopentylmethylamino)-5-propylpiperidin-1-yl]-2-methylpropan-1-one
CID 83997903
3-(cyclobutylmethylamino)-5-methylpiperidine-1-carboxamide
CID 83997098
1-[3-(cyclopropylmethylamino)-5-propylpiperidin-1-yl]-2-methylpropan-1-one
CID 83996520
1-[3-butyl-5-(cyclopentylmethylamino)piperidin-1-yl]ethanone
CID 83997819
3-(cyclopentylmethylamino)-5-(1-hydroxypropyl)piperidine-1-carboxamide
CID 83997808
3-(benzylamino)-5-propylpiperidine-1-carboxamide
CID 83993642
N-(cyclohexylmethyl)-1-ethyl-5-propylpiperidin-3-amine
CID 83998322
3-[1-carbamoyl-5-(ethylamino)piperidin-3-yl]propanoic acid
CID 83990342
3-propylpiperidine-1-carboxamide
CID 18466872
4-(cyclobutylmethylamino)piperidine-1-carboxamide
CID 43775245

Frequently Asked Questions

What is the IUPAC name of 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide?
The IUPAC name of 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide (CID 83997100) is 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide.
What is the SMILES notation for 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide?
The canonical SMILES for 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide is CCCC1CC(NCC2CCC2)CN(C(N)=O)C1.
What is the InChIKey of 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide?
The InChIKey is ACNCAKMZHWNDSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-2-4-12-7-13(10-17(9-12)14(15)18)16-8-11-5-3-6-11/h11-13,16H,2-10H2,1H3,(H2,15,18).
What are the key properties of 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide?
3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylmethylamino)-5-propylpiperidine-1-carboxamide is sourced from PubChem (CID 83997100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).