N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine

C15H32N2O — CID 103059669

IUPACN-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine
SMILESCCNC1CCOCC1CN(CC(C)C)C(C)C
InChIInChI=1S/C15H32N2O/c1-6-16-15-7-8-18-11-14(15)10-17(13(4)5)9-12(2)3/h12-16H,6-11H2,1-5H3
InChIKeyYLUUSYANUGJMFF-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.37
Rot. Bonds7

About N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine

N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine (PubChem CID 103059669) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine.

Molecular Properties

Compound NameN-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine
PubChem CID103059669
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC NameN-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine
SMILESCCNC1CCOCC1CN(CC(C)C)C(C)C
InChIInChI=1S/C15H32N2O/c1-6-16-15-7-8-18-11-14(15)10-17(13(4)5)9-12(2)3/h12-16H,6-11H2,1-5H3
InChIKeyYLUUSYANUGJMFF-UHFFFAOYSA-N
XLogP2.37
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[benzyl(propan-2-yl)amino]methyl]-N-ethyloxan-4-amine
CID 103058468
N-methyl-4-[[2-methylpropyl(propan-2-yl)amino]methyl]oxolan-3-amine
CID 66245583
3-[[cyclopentyl(2-methylpropyl)amino]methyl]-N-propyloxan-4-amine
CID 103060604
2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 21034317
3-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyloxan-4-amine
CID 103060336
N-ethyl-3-[[methyl-(4-methylcyclohexyl)amino]methyl]oxan-4-amine
CID 103059662
N-ethyl-3-[(4-ethyl-N-methylanilino)methyl]oxan-4-amine
CID 103059424
3-[[2-ethoxyethyl(methyl)amino]methyl]-N-ethyloxan-4-amine
CID 103060650
3-[[methyl(pentan-3-yl)amino]methyl]-N-propyloxan-4-amine
CID 103058871
3-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]-N-ethyloxan-4-amine
CID 103061010
3-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]-N-ethyloxan-4-amine
CID 103059901
N-ethyl-3-(2-methylpropylsulfanyl)oxan-4-amine
CID 64612141

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine?
The IUPAC name of N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine (CID 103059669) is N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine.
What is the SMILES notation for N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine?
The canonical SMILES for N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine is CCNC1CCOCC1CN(CC(C)C)C(C)C.
What is the InChIKey of N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine?
The InChIKey is YLUUSYANUGJMFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-6-16-15-7-8-18-11-14(15)10-17(13(4)5)9-12(2)3/h12-16H,6-11H2,1-5H3.
What are the key properties of N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine?
N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine has a molecular weight of 256.43 g/mol, XLogP of 2.37, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine is sourced from PubChem (CID 103059669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).