1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine

C13H27N3 — CID 62616122

IUPAC1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine
SMILESCN(C)C1CCN(CC2CCCC2N)CC1
InChIInChI=1S/C13H27N3/c1-15(2)12-6-8-16(9-7-12)10-11-4-3-5-13(11)14/h11-13H,3-10,14H2,1-2H3
InChIKeyPKTCLEMSABOWNY-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.14
Rot. Bonds3

About 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine

1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine (PubChem CID 62616122) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine
PubChem CID62616122
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine
SMILESCN(C)C1CCN(CC2CCCC2N)CC1
InChIInChI=1S/C13H27N3/c1-15(2)12-6-8-16(9-7-12)10-11-4-3-5-13(11)14/h11-13H,3-10,14H2,1-2H3
InChIKeyPKTCLEMSABOWNY-UHFFFAOYSA-N
XLogP1.14
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-[(2-methylcyclohexyl)methyl]piperidin-4-amine
CID 163161369
2-(pyrrolidin-1-ylmethyl)cyclopentan-1-amine
CID 23009063
2-[(4-ethylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 62609501
2-(azepan-1-ylmethyl)cycloheptan-1-amine
CID 62616403
1-(cyclopropylmethyl)-N,N-dimethylpiperidin-4-amine
CID 121338360
2-[(4-ethylpiperazin-1-yl)methyl]cycloheptan-1-amine
CID 62614630
2-[(4-methylazepan-1-yl)methyl]cycloheptan-1-amine
CID 63624498
2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine
CID 62615480
2-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine
CID 130816206
2-[(4-ethoxypiperidin-1-yl)methyl]cyclohexan-1-amine
CID 55093924
cis-(1S,2R)-1-N,1-N-dimethylcyclopentane-1,2-diamine
CID 55281587
2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]cyclohexan-1-amine
CID 64582780

Frequently Asked Questions

What is the IUPAC name of 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine (CID 62616122) is 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine is CN(C)C1CCN(CC2CCCC2N)CC1.
What is the InChIKey of 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine?
The InChIKey is PKTCLEMSABOWNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-15(2)12-6-8-16(9-7-12)10-11-4-3-5-13(11)14/h11-13H,3-10,14H2,1-2H3.
What are the key properties of 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine?
1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine has a molecular weight of 225.38 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-aminocyclopentyl)methyl]-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 62616122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).