N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide

C16H31N3O — CID 83110283

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide
SMILESCN(C)C1(CNC(=O)CCC2CCCCN2)CCCC1
InChIInChI=1S/C16H31N3O/c1-19(2)16(10-4-5-11-16)13-18-15(20)9-8-14-7-3-6-12-17-14/h14,17H,3-13H2,1-2H3,(H,18,20)
InChIKeyGTGUAIJMUHGVNQ-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.90
Rot. Bonds6

About N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide

N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide (PubChem CID 83110283) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide
PubChem CID83110283
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide
SMILESCN(C)C1(CNC(=O)CCC2CCCCN2)CCCC1
InChIInChI=1S/C16H31N3O/c1-19(2)16(10-4-5-11-16)13-18-15(20)9-8-14-7-3-6-12-17-14/h14,17H,3-13H2,1-2H3,(H,18,20)
InChIKeyGTGUAIJMUHGVNQ-UHFFFAOYSA-N
XLogP1.90
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 ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-[(2S)-piperidin-2-yl]propanamide
CID 94374343
(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride
CID 119682228
N-[[1-(dimethylamino)cyclopentyl]methyl]-2-piperidin-4-yloxyacetamide
CID 83111009
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-morpholin-3-ylacetamide
CID 105417370
N-[2-(dimethylamino)-3-ethylpentyl]-3-piperidin-2-ylpropanamide
CID 62211126
N-(2-cyclohexylethyl)-3-piperidin-2-ylpropanamide
CID 62210016
N,N-dimethyl-1-[(1-piperidin-2-ylpropan-2-ylamino)methyl]cyclobutan-1-amine
CID 105414670
N-[3-(diethylamino)propyl]-3-piperidin-2-ylpropanamide
CID 62210496
6-[[1-(dimethylamino)cyclopentyl]methylamino]-6-oxohexanoic acid
CID 83116908
N-[[1-(dimethylamino)cyclopentyl]methyl]-4,4,4-trifluorobutanamide
CID 122564590
2-(cyclopentylamino)-N-[[1-(dimethylamino)cyclohexyl]methyl]acetamide
CID 60687122
3-chloro-N-[[1-(dimethylamino)cyclobutyl]methyl]propanamide
CID 105415955

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide (CID 83110283) is N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide is CN(C)C1(CNC(=O)CCC2CCCCN2)CCCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide?
The InChIKey is GTGUAIJMUHGVNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-19(2)16(10-4-5-11-16)13-18-15(20)9-8-14-7-3-6-12-17-14/h14,17H,3-13H2,1-2H3,(H,18,20).
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide?
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide has a molecular weight of 281.44 g/mol, XLogP of 1.90, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide is sourced from PubChem (CID 83110283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).