N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine

C11H21N — CID 130920507

IUPACN-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine
SMILESCC1CCC(N(C)CC2CC2)C1
InChIInChI=1S/C11H21N/c1-9-3-6-11(7-9)12(2)8-10-4-5-10/h9-11H,3-8H2,1-2H3
InChIKeyNCANLAUVVHUBSS-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.52
Rot. Bonds3

About N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine

N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine (PubChem CID 130920507) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine
PubChem CID130920507
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine
SMILESCC1CCC(N(C)CC2CC2)C1
InChIInChI=1S/C11H21N/c1-9-3-6-11(7-9)12(2)8-10-4-5-10/h9-11H,3-8H2,1-2H3
InChIKeyNCANLAUVVHUBSS-UHFFFAOYSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine?
The IUPAC name of N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine (CID 130920507) is N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine is CC1CCC(N(C)CC2CC2)C1.
What is the InChIKey of N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine?
The InChIKey is NCANLAUVVHUBSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9-3-6-11(7-9)12(2)8-10-4-5-10/h9-11H,3-8H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine?
N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine has a molecular weight of 167.30 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N,3-dimethylcyclopentan-1-amine is sourced from PubChem (CID 130920507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).