2-cyclopropyl-1-(oxan-4-yl)propan-2-amine

C11H21NO — CID 82237683

IUPAC2-cyclopropyl-1-(oxan-4-yl)propan-2-amine
SMILESCC(N)(CC1CCOCC1)C1CC1
InChIInChI=1S/C11H21NO/c1-11(12,10-2-3-10)8-9-4-6-13-7-5-9/h9-10H,2-8,12H2,1H3
InChIKeyNSLOPUUNCSPKCC-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.93
Rot. Bonds3

About 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine

2-cyclopropyl-1-(oxan-4-yl)propan-2-amine (PubChem CID 82237683) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(oxan-4-yl)propan-2-amine
PubChem CID82237683
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-cyclopropyl-1-(oxan-4-yl)propan-2-amine
SMILESCC(N)(CC1CCOCC1)C1CC1
InChIInChI=1S/C11H21NO/c1-11(12,10-2-3-10)8-9-4-6-13-7-5-9/h9-10H,2-8,12H2,1H3
InChIKeyNSLOPUUNCSPKCC-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(oxan-4-yl)butan-2-amine
CID 63936671
N-tert-butyl-2-cyclopropyl-2-methyl-3-(oxan-4-yl)propan-1-amine
CID 83160445
2-cyclopropyl-1-(oxolan-2-yl)propan-2-amine
CID 82237698
2,2-dimethyl-3-(oxan-4-yl)propanal
CID 87406928
1-(4-tert-butylcyclohexyl)-2-(oxan-4-yl)ethanamine
CID 65402159
(2S)-2-cyclopropylbutan-2-amine
CID 93299299
2-methyl-2-(oxan-4-ylmethyl)butan-1-ol
CID 66058541
4-[2-(bromomethyl)-2-methylbutyl]oxane
CID 66050045
(3S)-3-(2,2-dimethylpropyl)oxolane
CID 139100718
2-cyclopropyl-2-methyl-6-(oxan-4-yl)hexan-1-amine
CID 114192558
2-ethyl-2-(oxan-4-ylmethyl)propane-1,3-diol
CID 79450037
2-amino-1-cyclohexylpropan-2-ol
CID 57094409

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine?
The IUPAC name of 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine (CID 82237683) is 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine.
What is the SMILES notation for 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine?
The canonical SMILES for 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine is CC(N)(CC1CCOCC1)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine?
The InChIKey is NSLOPUUNCSPKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-11(12,10-2-3-10)8-9-4-6-13-7-5-9/h9-10H,2-8,12H2,1H3.
What are the key properties of 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine?
2-cyclopropyl-1-(oxan-4-yl)propan-2-amine has a molecular weight of 183.29 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(oxan-4-yl)propan-2-amine is sourced from PubChem (CID 82237683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).