5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine

C17H32N2 — CID 79855110

IUPAC5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine
SMILESCCNC1C(CN(CC2CC2)C2CC2)CCC1(C)C
InChIInChI=1S/C17H32N2/c1-4-18-16-14(9-10-17(16,2)3)12-19(15-7-8-15)11-13-5-6-13/h13-16,18H,4-12H2,1-3H3
InChIKeyKQVSHGVPLKYBKX-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.28
Rot. Bonds7

About 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine

5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine (PubChem CID 79855110) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine
PubChem CID79855110
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine
SMILESCCNC1C(CN(CC2CC2)C2CC2)CCC1(C)C
InChIInChI=1S/C17H32N2/c1-4-18-16-14(9-10-17(16,2)3)12-19(15-7-8-15)11-13-5-6-13/h13-16,18H,4-12H2,1-3H3
InChIKeyKQVSHGVPLKYBKX-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The IUPAC name of 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine (CID 79855110) is 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine.
What is the SMILES notation for 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The canonical SMILES for 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine is CCNC1C(CN(CC2CC2)C2CC2)CCC1(C)C.
What is the InChIKey of 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine?
The InChIKey is KQVSHGVPLKYBKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-4-18-16-14(9-10-17(16,2)3)12-19(15-7-8-15)11-13-5-6-13/h13-16,18H,4-12H2,1-3H3.
What are the key properties of 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine?
5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine has a molecular weight of 264.46 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine is sourced from PubChem (CID 79855110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).