1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine

C13H28N2 — CID 143387072

IUPAC1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine
SMILESCCCCN(C)CC1(N(C)C)CCCC1
InChIInChI=1S/C13H28N2/c1-5-6-11-15(4)12-13(14(2)3)9-7-8-10-13/h5-12H2,1-4H3
InChIKeyGNNNCTXZRQHFQO-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.59
Rot. Bonds6

About 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine

1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine (PubChem CID 143387072) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine
PubChem CID143387072
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine
SMILESCCCCN(C)CC1(N(C)C)CCCC1
InChIInChI=1S/C13H28N2/c1-5-6-11-15(4)12-13(14(2)3)9-7-8-10-13/h5-12H2,1-4H3
InChIKeyGNNNCTXZRQHFQO-UHFFFAOYSA-N
XLogP2.59
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine?
The IUPAC name of 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine (CID 143387072) is 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine.
What is the SMILES notation for 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine?
The canonical SMILES for 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine is CCCCN(C)CC1(N(C)C)CCCC1.
What is the InChIKey of 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine?
The InChIKey is GNNNCTXZRQHFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-6-11-15(4)12-13(14(2)3)9-7-8-10-13/h5-12H2,1-4H3.
What are the key properties of 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine?
1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.59, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[butyl(methyl)amino]methyl]-N,N-dimethylcyclopentan-1-amine is sourced from PubChem (CID 143387072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).