N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide

C16H31N3O — CID 107411593

IUPACN,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide
SMILESCC1CCC(CNC2CCN(CC(=O)N(C)C)CC2)C1
InChIInChI=1S/C16H31N3O/c1-13-4-5-14(10-13)11-17-15-6-8-19(9-7-15)12-16(20)18(2)3/h13-15,17H,4-12H2,1-3H3
InChIKeyYFULOGJPSBTTAI-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.56
Rot. Bonds5

About N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide

N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide (PubChem CID 107411593) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide
PubChem CID107411593
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide
SMILESCC1CCC(CNC2CCN(CC(=O)N(C)C)CC2)C1
InChIInChI=1S/C16H31N3O/c1-13-4-5-14(10-13)11-17-15-6-8-19(9-7-15)12-16(20)18(2)3/h13-15,17H,4-12H2,1-3H3
InChIKeyYFULOGJPSBTTAI-UHFFFAOYSA-N
XLogP1.56
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-methyl-N-(4-methylcyclohexyl)acetamide;hydrochloride
CID 119926559
1-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]ethanone
CID 107411452
N-cyclopropyl-2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-methylacetamide;hydrochloride
CID 119926792
2-[4-[(2-hydroxycyclohexyl)methylamino]piperidin-1-yl]-N,N-dimethylacetamide
CID 64928848
2-[4-(2-aminoethylamino)piperidin-1-yl]-N,N-dimethylacetamide
CID 60887213
N,N-dimethyl-2-(4-methylpiperidin-1-yl)acetamide;ethane
CID 145317125
N,N-dimethyl-2-[4-(octylamino)piperidin-1-yl]acetamide
CID 115566789
N,N-dimethyl-2-[4-(3-methylbut-2-enylamino)piperidin-1-yl]acetamide
CID 103522748
2-[4-[(2-hydroxy-2-methylpropyl)amino]piperidin-1-yl]-N,N-dimethylacetamide
CID 65103485
2-[4-(3-hydroxypropylamino)piperidin-1-yl]-N,N-dimethylacetamide
CID 43770571
2-[4-(2,2-difluoroethylamino)piperidin-1-yl]-N,N-dimethylacetamide
CID 113303615
N,N-dimethyl-2-[4-(propylaminomethyl)piperidin-1-yl]acetamide
CID 63849787

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide?
The IUPAC name of N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide (CID 107411593) is N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide is CC1CCC(CNC2CCN(CC(=O)N(C)C)CC2)C1.
What is the InChIKey of N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide?
The InChIKey is YFULOGJPSBTTAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-13-4-5-14(10-13)11-17-15-6-8-19(9-7-15)12-16(20)18(2)3/h13-15,17H,4-12H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide?
N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide has a molecular weight of 281.44 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]acetamide is sourced from PubChem (CID 107411593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).