N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide

C14H27N3O — CID 105418341

IUPACN-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide
SMILESCC1NCCCC1C(=O)NCC1(N(C)C)CCC1
InChIInChI=1S/C14H27N3O/c1-11-12(6-4-9-15-11)13(18)16-10-14(17(2)3)7-5-8-14/h11-12,15H,4-10H2,1-3H3,(H,16,18)
InChIKeyGLPOIHYWMAKXCF-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.98
Rot. Bonds4

About N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide

N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide (PubChem CID 105418341) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide
PubChem CID105418341
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide
SMILESCC1NCCCC1C(=O)NCC1(N(C)C)CCC1
InChIInChI=1S/C14H27N3O/c1-11-12(6-4-9-15-11)13(18)16-10-14(17(2)3)7-5-8-14/h11-12,15H,4-10H2,1-3H3,(H,16,18)
InChIKeyGLPOIHYWMAKXCF-UHFFFAOYSA-N
XLogP0.98
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 ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-prop-2-ynylpiperidine-3-carboxamide
CID 131048074
(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride
CID 119682228
(2R)-N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]pyrrolidine-2-carboxamide
CID 103814097
(1S,6R)-6-[[1-(dimethylamino)cyclobutyl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 105414269
N-[[1-(dimethylamino)cyclohexyl]methyl]-4-methylpyrrolidine-3-carboxamide
CID 55231312
6-[[1-(dimethylamino)cyclobutyl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 105414256
(2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide
CID 130891391
N-[[4-(dimethylamino)oxan-4-yl]methyl]pyrrolidine-2-carboxamide
CID 119885272
N-but-2-ynyl-2-methylpiperidine-3-carboxamide
CID 127003919
N-[(3-methoxyoxolan-3-yl)methyl]-2-methylpiperidine-3-carboxamide
CID 104762009
2-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 105419502
6-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 83108655

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide?
The IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide (CID 105418341) is N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide?
The canonical SMILES for N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide is CC1NCCCC1C(=O)NCC1(N(C)C)CCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide?
The InChIKey is GLPOIHYWMAKXCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-11-12(6-4-9-15-11)13(18)16-10-14(17(2)3)7-5-8-14/h11-12,15H,4-10H2,1-3H3,(H,16,18).
What are the key properties of N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide?
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide is sourced from PubChem (CID 105418341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).