[2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine

C16H31N3 — CID 79857129

IUPAC[2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine
SMILESCC1(C)CCCC1(CN)N1CCC(N2CCCC2)C1
InChIInChI=1S/C16H31N3/c1-15(2)7-5-8-16(15,13-17)19-11-6-14(12-19)18-9-3-4-10-18/h14H,3-13,17H2,1-2H3
InChIKeyITZXSBDHLXRVHP-UHFFFAOYSA-N
MW265.44 g/mol
LogP2.06
Rot. Bonds3

About [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine

[2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine (PubChem CID 79857129) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine
PubChem CID79857129
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC Name[2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine
SMILESCC1(C)CCCC1(CN)N1CCC(N2CCCC2)C1
InChIInChI=1S/C16H31N3/c1-15(2)7-5-8-16(15,13-17)19-11-6-14(12-19)18-9-3-4-10-18/h14H,3-13,17H2,1-2H3
InChIKeyITZXSBDHLXRVHP-UHFFFAOYSA-N
XLogP2.06
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2,2-dimethyl-1-(3-piperidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine
CID 79857355
[2,2-dimethyl-1-(3-morpholin-4-ylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 79834112
[1-(4-cyclopropylpiperazin-1-yl)-2,2-dimethylcyclopentyl]methanamine
CID 79858011
[1-(azepan-1-yl)-2,2-dimethylcyclopentyl]methanamine
CID 79856298
1-[1-(aminomethyl)-2,2-dimethylcyclohexyl]-N,N-dimethylpyrrolidin-3-amine
CID 79847823
[1-(3-piperidin-1-ylpyrrolidin-1-yl)cyclopropyl]methanamine
CID 106661223
[3,3-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine
CID 80705889
[1-(3-ethyl-4-methylpiperazin-1-yl)-2,2-dimethylcyclopentyl]methanamine
CID 79857357
[1-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylcyclopentyl]methanamine
CID 79857920
[1-(3,4-dimethylpiperazin-1-yl)-2,2-dimethylcyclohexyl]methanamine
CID 79847121
[3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
CID 79916036
[1-(3-ethyl-4-methylpiperazin-1-yl)-2,2-dimethylcyclohexyl]methanamine
CID 79847299

Frequently Asked Questions

What is the IUPAC name of [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine?
The IUPAC name of [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine (CID 79857129) is [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine.
What is the SMILES notation for [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine?
The canonical SMILES for [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine is CC1(C)CCCC1(CN)N1CCC(N2CCCC2)C1.
What is the InChIKey of [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine?
The InChIKey is ITZXSBDHLXRVHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-15(2)7-5-8-16(15,13-17)19-11-6-14(12-19)18-9-3-4-10-18/h14H,3-13,17H2,1-2H3.
What are the key properties of [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine?
[2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine has a molecular weight of 265.44 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2,2-dimethyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine is sourced from PubChem (CID 79857129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).