N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine

C15H29NO — CID 82933491

IUPACN-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC1(C2CCCCC2)CCOC1
InChIInChI=1S/C15H29NO/c1-13(2)10-16-11-15(8-9-17-12-15)14-6-4-3-5-7-14/h13-14,16H,3-12H2,1-2H3
InChIKeyOSHJSSJIHRVGLU-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.22
Rot. Bonds5

About N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine

N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine (PubChem CID 82933491) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine
PubChem CID82933491
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC1(C2CCCCC2)CCOC1
InChIInChI=1S/C15H29NO/c1-13(2)10-16-11-15(8-9-17-12-15)14-6-4-3-5-7-14/h13-14,16H,3-12H2,1-2H3
InChIKeyOSHJSSJIHRVGLU-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-cycloheptyloxolan-3-yl)methyl]propan-2-amine
CID 82934192
N-[(3-cyclopropyloxolan-3-yl)methyl]ethanamine
CID 104819411
N-[[3-[(2-ethylazepan-1-yl)methyl]oxolan-3-yl]methyl]-2-methylpropan-1-amine
CID 104691962
N-[(4-cycloheptyloxan-4-yl)methyl]propan-1-amine
CID 82933709
2-methyl-N-[[3-[3-(oxolan-2-yl)propyl]oxolan-3-yl]methyl]propan-1-amine
CID 65164937
N-[(4-cyclopentyloxan-4-yl)methyl]-2-methylpropan-2-amine
CID 82932929
2-methyl-N-[[4-(2-methylpropyl)oxan-4-yl]methyl]propan-1-amine
CID 62905571
N-[[3-[[cyclopropylmethyl(propan-2-yl)amino]methyl]oxolan-3-yl]methyl]-2-methylpropan-1-amine
CID 62260391
1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol
CID 62261044
2-methyl-N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]propan-1-amine
CID 65166397
N-[(1-cyclohexylcyclohexyl)methyl]propan-2-amine
CID 82933466
N-[(1-cyclopentylcyclohexyl)methyl]ethanamine
CID 82932904

Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine (CID 82933491) is N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine is CC(C)CNCC1(C2CCCCC2)CCOC1.
What is the InChIKey of N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine?
The InChIKey is OSHJSSJIHRVGLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-13(2)10-16-11-15(8-9-17-12-15)14-6-4-3-5-7-14/h13-14,16H,3-12H2,1-2H3.
What are the key properties of N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine?
N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine has a molecular weight of 239.40 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclohexyloxolan-3-yl)methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 82933491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).