3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine

C12H24N2 — CID 107417313

IUPAC3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine
SMILESCC1CCCC1CNC1CCC(N)C1
InChIInChI=1S/C12H24N2/c1-9-3-2-4-10(9)8-14-12-6-5-11(13)7-12/h9-12,14H,2-8,13H2,1H3
InChIKeySUMJUZJYMWSKTD-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.89
Rot. Bonds3

About 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine

3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine (PubChem CID 107417313) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine.

Molecular Properties

Compound Name3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine
PubChem CID107417313
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine
SMILESCC1CCCC1CNC1CCC(N)C1
InChIInChI=1S/C12H24N2/c1-9-3-2-4-10(9)8-14-12-6-5-11(13)7-12/h9-12,14H,2-8,13H2,1H3
InChIKeySUMJUZJYMWSKTD-UHFFFAOYSA-N
XLogP1.89
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopropyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine
CID 107417299
N-[(2-methylcyclopentyl)methyl]cyclooctanamine
CID 107417462
N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine
CID 107417481
N-[(2-methylcyclohexyl)methyl]-3-propan-2-ylcyclohexan-1-amine
CID 107448430
3-N-(cyclohexylmethyl)cyclopentane-1,3-diamine
CID 79461432
1,5-dimethyl-N-[(2-methylcyclopentyl)methyl]pyrrolidin-3-amine
CID 107417196
3-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1,3-diamine
CID 79461789
N-[(2-methylcyclohexyl)methyl]thietan-3-amine
CID 130650863
N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine
CID 107417410
N-[(2-methylcyclohexyl)methyl]-3-propan-2-ylcyclobutan-1-amine
CID 103561813
3-N-[(3-amino-2-methylcyclohexyl)methyl]-4-methylcyclohexane-1,3-diamine
CID 138507643
2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine
CID 107417002

Frequently Asked Questions

What is the IUPAC name of 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine?
The IUPAC name of 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine (CID 107417313) is 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine.
What is the SMILES notation for 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine?
The canonical SMILES for 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine is CC1CCCC1CNC1CCC(N)C1.
What is the InChIKey of 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine?
The InChIKey is SUMJUZJYMWSKTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-9-3-2-4-10(9)8-14-12-6-5-11(13)7-12/h9-12,14H,2-8,13H2,1H3.
What are the key properties of 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine?
3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine has a molecular weight of 196.34 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine is sourced from PubChem (CID 107417313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).