1-methyl-N-(2-methylcyclopentyl)azepan-4-amine

C13H26N2 — CID 65075133

IUPAC1-methyl-N-(2-methylcyclopentyl)azepan-4-amine
SMILESCC1CCCC1NC1CCCN(C)CC1
InChIInChI=1S/C13H26N2/c1-11-5-3-7-13(11)14-12-6-4-9-15(2)10-8-12/h11-14H,3-10H2,1-2H3
InChIKeyXXOKNWRMXQAIGF-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds2

About 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine

1-methyl-N-(2-methylcyclopentyl)azepan-4-amine (PubChem CID 65075133) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine.

Molecular Properties

Compound Name1-methyl-N-(2-methylcyclopentyl)azepan-4-amine
PubChem CID65075133
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-methyl-N-(2-methylcyclopentyl)azepan-4-amine
SMILESCC1CCCC1NC1CCCN(C)CC1
InChIInChI=1S/C13H26N2/c1-11-5-3-7-13(11)14-12-6-4-9-15(2)10-8-12/h11-14H,3-10H2,1-2H3
InChIKeyXXOKNWRMXQAIGF-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-N-(2-methylcyclopentyl)pyrrolidin-3-amine
CID 63278241
(3S)-1-methyl-N-[(1S,2R)-2-methylcyclohexyl]pyrrolidin-3-amine
CID 124708701
N-cyclopropyl-1-methylazepan-4-amine
CID 65071330
N-(2,6-dimethylcyclohexyl)-1-methylpiperidin-4-amine
CID 43215959
[2-[(1-methylazepan-4-yl)amino]cyclopentyl]methanol
CID 103859826
1-methyl-N-(2-methylcyclobutyl)piperidin-3-amine
CID 126973384
1-tert-butyl-N-(2-methylcyclopentyl)piperidin-4-amine
CID 65045786
1-methyl-N-(2-methylsulfanylcyclohexyl)azepan-4-amine
CID 103859823
cis-(1R,2S)-N-cyclopropyl-2-methylcyclohexan-1-amine
CID 30048017
N-(2,3-dimethylcyclohexyl)-1-propylazepan-4-amine
CID 65073049
N-(2-methylcyclopentyl)-1-methylsulfonylpiperidin-4-amine
CID 65044453
N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride
CID 53408550

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine?
The IUPAC name of 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine (CID 65075133) is 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine.
What is the SMILES notation for 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine?
The canonical SMILES for 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine is CC1CCCC1NC1CCCN(C)CC1.
What is the InChIKey of 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine?
The InChIKey is XXOKNWRMXQAIGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11-5-3-7-13(11)14-12-6-4-9-15(2)10-8-12/h11-14H,3-10H2,1-2H3.
What are the key properties of 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine?
1-methyl-N-(2-methylcyclopentyl)azepan-4-amine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-methylcyclopentyl)azepan-4-amine is sourced from PubChem (CID 65075133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).