N-(1-cyclopropylpropan-2-yl)oxan-4-amine

C11H21NO — CID 63989117

IUPACN-(1-cyclopropylpropan-2-yl)oxan-4-amine
SMILESCC(CC1CC1)NC1CCOCC1
InChIInChI=1S/C11H21NO/c1-9(8-10-2-3-10)12-11-4-6-13-7-5-11/h9-12H,2-8H2,1H3
InChIKeyGPVOMVJZYDGWNK-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.94
Rot. Bonds4

About N-(1-cyclopropylpropan-2-yl)oxan-4-amine

N-(1-cyclopropylpropan-2-yl)oxan-4-amine (PubChem CID 63989117) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)oxan-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)oxan-4-amine
PubChem CID63989117
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-(1-cyclopropylpropan-2-yl)oxan-4-amine
SMILESCC(CC1CC1)NC1CCOCC1
InChIInChI=1S/C11H21NO/c1-9(8-10-2-3-10)12-11-4-6-13-7-5-11/h9-12H,2-8H2,1H3
InChIKeyGPVOMVJZYDGWNK-UHFFFAOYSA-N
XLogP1.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-cyclopropylpropan-2-yl)oxan-4-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-(1-cyclopropylpropan-2-yl)oxan-4-amine?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)oxan-4-amine (CID 63989117) is N-(1-cyclopropylpropan-2-yl)oxan-4-amine.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)oxan-4-amine?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)oxan-4-amine is CC(CC1CC1)NC1CCOCC1.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)oxan-4-amine?
The InChIKey is GPVOMVJZYDGWNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(8-10-2-3-10)12-11-4-6-13-7-5-11/h9-12H,2-8H2,1H3.
What are the key properties of N-(1-cyclopropylpropan-2-yl)oxan-4-amine?
N-(1-cyclopropylpropan-2-yl)oxan-4-amine has a molecular weight of 183.29 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)oxan-4-amine is sourced from PubChem (CID 63989117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).