4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine

C16H32N2O — CID 66256771

IUPAC4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine
SMILESCCCNC1COCC1CN(C)C1CCCC(C)C1
InChIInChI=1S/C16H32N2O/c1-4-8-17-16-12-19-11-14(16)10-18(3)15-7-5-6-13(2)9-15/h13-17H,4-12H2,1-3H3
InChIKeyNTGGLOLSULPRBW-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.51
Rot. Bonds6

About 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine

4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine (PubChem CID 66256771) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine.

Molecular Properties

Compound Name4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine
PubChem CID66256771
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine
SMILESCCCNC1COCC1CN(C)C1CCCC(C)C1
InChIInChI=1S/C16H32N2O/c1-4-8-17-16-12-19-11-14(16)10-18(3)15-7-5-6-13(2)9-15/h13-17H,4-12H2,1-3H3
InChIKeyNTGGLOLSULPRBW-UHFFFAOYSA-N
XLogP2.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 63494785
4-[[cyclopentyl(ethyl)amino]methyl]-N-propyloxolan-3-amine
CID 66254473
3-[[cyclopropyl(methyl)amino]methyl]-N-propyloxan-4-amine
CID 103058724
4-[[cyclopropyl(ethyl)amino]methyl]-N-propyloxolan-3-amine
CID 66256381
4-(diethylaminomethyl)-N-propyloxolan-3-amine
CID 66256952
N-[[4-(ethylamino)oxolan-3-yl]methyl]-N,1-dimethylpiperidin-3-amine
CID 66258960
2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine
CID 63493452
2-[[cyclohexyl(methyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 62615295
N-ethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-amine
CID 82739733
N,1-dimethyl-N-[[5-methyl-2-(propylamino)cyclohexyl]methyl]piperidin-4-amine
CID 62616944
4-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]-N-propyloxolan-3-amine
CID 79320006
4-[[methyl(4-methylpentan-2-yl)amino]methyl]-N-propyloxolan-3-amine
CID 66255630

Frequently Asked Questions

What is the IUPAC name of 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine?
The IUPAC name of 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine (CID 66256771) is 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine.
What is the SMILES notation for 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine?
The canonical SMILES for 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine is CCCNC1COCC1CN(C)C1CCCC(C)C1.
What is the InChIKey of 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine?
The InChIKey is NTGGLOLSULPRBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-4-8-17-16-12-19-11-14(16)10-18(3)15-7-5-6-13(2)9-15/h13-17H,4-12H2,1-3H3.
What are the key properties of 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine?
4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine has a molecular weight of 268.44 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propyloxolan-3-amine is sourced from PubChem (CID 66256771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).