N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine

C14H27NO2 — CID 62905041

IUPACN-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine
SMILESCC(C)OCCC1(CNC2CC2)CCOCC1
InChIInChI=1S/C14H27NO2/c1-12(2)17-10-7-14(5-8-16-9-6-14)11-15-13-3-4-13/h12-13,15H,3-11H2,1-2H3
InChIKeyCYBICRNFCRPMIE-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.35
Rot. Bonds7

About N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine

N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine (PubChem CID 62905041) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine
PubChem CID62905041
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine
SMILESCC(C)OCCC1(CNC2CC2)CCOCC1
InChIInChI=1S/C14H27NO2/c1-12(2)17-10-7-14(5-8-16-9-6-14)11-15-13-3-4-13/h12-13,15H,3-11H2,1-2H3
InChIKeyCYBICRNFCRPMIE-UHFFFAOYSA-N
XLogP2.35
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine 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

N-[[3-(2-propan-2-yloxyethyl)oxolan-3-yl]methyl]propan-1-amine
CID 62719201
N-[[4-[[methyl(2-methylpropyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62392859
N-[[3-(4-methylpentyl)oxolan-3-yl]methyl]cyclopropanamine
CID 83167933
3-(chloromethyl)-3-(2-propan-2-yloxyethyl)oxolane
CID 66035244
N-[[4-(oxan-4-ylmethyl)oxan-4-yl]methyl]cyclopropanamine
CID 62907143
N-[[3-(trimethylsilylmethyl)oxolan-3-yl]methyl]cyclopropanamine
CID 106323583
N-[[1-(2-methylpropyl)cyclopropyl]methyl]oxan-4-amine
CID 115690960
4-[(propan-2-ylamino)methyl]-4-(2-propan-2-yloxyethyl)cyclohexan-1-ol
CID 112745404
N-[[3-[[bis(2-methylpropyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 62257834
N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 63955478
N-[[4-[(4-fluorophenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62906105
N-[[4-[(4,4-dimethylpiperidin-1-yl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62931491

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine (CID 62905041) is N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine is CC(C)OCCC1(CNC2CC2)CCOCC1.
What is the InChIKey of N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine?
The InChIKey is CYBICRNFCRPMIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-12(2)17-10-7-14(5-8-16-9-6-14)11-15-13-3-4-13/h12-13,15H,3-11H2,1-2H3.
What are the key properties of N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine?
N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine has a molecular weight of 241.37 g/mol, XLogP of 2.35, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-propan-2-yloxyethyl)oxan-4-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62905041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).