1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine

C10H22N2 — CID 79856786

IUPAC1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
SMILESCCNC1(CN)CCCC1(C)C
InChIInChI=1S/C10H22N2/c1-4-12-10(8-11)7-5-6-9(10,2)3/h12H,4-8,11H2,1-3H3
InChIKeyZXMMIYULFKUPQV-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.50
Rot. Bonds3

About 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine

1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine (PubChem CID 79856786) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
PubChem CID79856786
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
SMILESCCNC1(CN)CCCC1(C)C
InChIInChI=1S/C10H22N2/c1-4-12-10(8-11)7-5-6-9(10,2)3/h12H,4-8,11H2,1-3H3
InChIKeyZXMMIYULFKUPQV-UHFFFAOYSA-N
XLogP1.50
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine (CID 79856786) is 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine is CCNC1(CN)CCCC1(C)C.
What is the InChIKey of 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The InChIKey is ZXMMIYULFKUPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-4-12-10(8-11)7-5-6-9(10,2)3/h12H,4-8,11H2,1-3H3.
What are the key properties of 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine?
1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine has a molecular weight of 170.30 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine is sourced from PubChem (CID 79856786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).