N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine

C15H31N — CID 115846405

IUPACN-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine
SMILESCCNC(CC(C)CC)C1C(C)(C)C1(C)C
InChIInChI=1S/C15H31N/c1-8-11(3)10-12(16-9-2)13-14(4,5)15(13,6)7/h11-13,16H,8-10H2,1-7H3
InChIKeyCXJBEQRHNFGAHJ-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.08
Rot. Bonds6

About N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine

N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine (PubChem CID 115846405) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine
PubChem CID115846405
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC NameN-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine
SMILESCCNC(CC(C)CC)C1C(C)(C)C1(C)C
InChIInChI=1S/C15H31N/c1-8-11(3)10-12(16-9-2)13-14(4,5)15(13,6)7/h11-13,16H,8-10H2,1-7H3
InChIKeyCXJBEQRHNFGAHJ-UHFFFAOYSA-N
XLogP4.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine?
The IUPAC name of N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine (CID 115846405) is N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine.
What is the SMILES notation for N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine?
The canonical SMILES for N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine is CCNC(CC(C)CC)C1C(C)(C)C1(C)C.
What is the InChIKey of N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine?
The InChIKey is CXJBEQRHNFGAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-8-11(3)10-12(16-9-2)13-14(4,5)15(13,6)7/h11-13,16H,8-10H2,1-7H3.
What are the key properties of N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine?
N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.08, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-1-(2,2,3,3-tetramethylcyclopropyl)pentan-1-amine is sourced from PubChem (CID 115846405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).