1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine

C13H26N2 — CID 60852096

IUPAC1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine
SMILESCCN(CC1(N)CCCC1)C1CCCC1
InChIInChI=1S/C13H26N2/c1-2-15(12-7-3-4-8-12)11-13(14)9-5-6-10-13/h12H,2-11,14H2,1H3
InChIKeyNVVXAGMOMBLCTQ-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.52
Rot. Bonds4

About 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine

1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine (PubChem CID 60852096) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine
PubChem CID60852096
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine
SMILESCCN(CC1(N)CCCC1)C1CCCC1
InChIInChI=1S/C13H26N2/c1-2-15(12-7-3-4-8-12)11-13(14)9-5-6-10-13/h12H,2-11,14H2,1H3
InChIKeyNVVXAGMOMBLCTQ-UHFFFAOYSA-N
XLogP2.52
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine?
The IUPAC name of 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine (CID 60852096) is 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine?
The canonical SMILES for 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine is CCN(CC1(N)CCCC1)C1CCCC1.
What is the InChIKey of 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine?
The InChIKey is NVVXAGMOMBLCTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-15(12-7-3-4-8-12)11-13(14)9-5-6-10-13/h12H,2-11,14H2,1H3.
What are the key properties of 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine?
1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine is sourced from PubChem (CID 60852096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).