2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine

C12H23NO — CID 103578739

IUPAC2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine
SMILESCC(C)CCNC1CCOC1C1CC1
InChIInChI=1S/C12H23NO/c1-9(2)5-7-13-11-6-8-14-12(11)10-3-4-10/h9-13H,3-8H2,1-2H3
InChIKeyZIHUGPLORCTHBT-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.19
Rot. Bonds5

About 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine

2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine (PubChem CID 103578739) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine
PubChem CID103578739
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine
SMILESCC(C)CCNC1CCOC1C1CC1
InChIInChI=1S/C12H23NO/c1-9(2)5-7-13-11-6-8-14-12(11)10-3-4-10/h9-13H,3-8H2,1-2H3
InChIKeyZIHUGPLORCTHBT-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine with MolForge

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

Launch Full Analysis

Related Compounds

(2S,3S,4S,5R)-4-fluoro-N-methyl-5-(2-methylpropyl)-2-propan-2-yloxolan-3-amine
CID 176612956
(2S,4S)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995025
(2R,4S)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995028
(2S,4R)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995031
(2R,4R)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995033
(2R,4S)-4-(2-fluoroethoxy)-2-(2-methylpropyl)pyrrolidine
CID 99995037
(2S,4S)-4-(2-fluoroethoxy)-2-(2-methylpropyl)pyrrolidine
CID 99995039
(2R,4R)-4-(2-fluoroethoxy)-2-(2-methylpropyl)pyrrolidine
CID 99995042
(2S,4R)-4-(2-fluoroethoxy)-2-(2-methylpropyl)pyrrolidine
CID 99995044
4-(2-Fluoro-ethoxy)-2-isopropyl-pyrrolidine
CID 102568647
4-(2-Fluoro-ethoxy)-2-isobutyl-pyrrolidine
CID 102568648
2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine
CID 102613100

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine?
The IUPAC name of 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine (CID 103578739) is 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine.
What is the SMILES notation for 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine?
The canonical SMILES for 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine is CC(C)CCNC1CCOC1C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine?
The InChIKey is ZIHUGPLORCTHBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9(2)5-7-13-11-6-8-14-12(11)10-3-4-10/h9-13H,3-8H2,1-2H3.
What are the key properties of 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine?
2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine has a molecular weight of 197.32 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(3-methylbutyl)oxolan-3-amine is sourced from PubChem (CID 103578739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).