N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine

C16H32N2O — CID 62391503

IUPACN-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine
SMILESCCNCC1(CN(CC(C)C)C2CC2)CCOCC1
InChIInChI=1S/C16H32N2O/c1-4-17-12-16(7-9-19-10-8-16)13-18(11-14(2)3)15-5-6-15/h14-15,17H,4-13H2,1-3H3
InChIKeyOGEZMBMAPXBTMC-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.51
Rot. Bonds8

About N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine

N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine (PubChem CID 62391503) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine.

Molecular Properties

Compound NameN-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine
PubChem CID62391503
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine
SMILESCCNCC1(CN(CC(C)C)C2CC2)CCOCC1
InChIInChI=1S/C16H32N2O/c1-4-17-12-16(7-9-19-10-8-16)13-18(11-14(2)3)15-5-6-15/h14-15,17H,4-13H2,1-3H3
InChIKeyOGEZMBMAPXBTMC-UHFFFAOYSA-N
XLogP2.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
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

Analyze N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine with MolForge

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Related Compounds

3-[cyclobutyl-[[4-(ethylaminomethyl)oxan-4-yl]methyl]amino]propan-1-ol
CID 102870849
2-[cyclobutyl-[[4-[(2-methylpropylamino)methyl]oxan-4-yl]methyl]amino]ethanol
CID 102871012
N-[[4-[[cyclobutylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]ethanamine
CID 62862435
N-[[3-(ethylaminomethyl)oxolan-3-yl]methyl]-N-methylcyclopropanamine
CID 62262540
N-[[1-[[cyclopropyl(2-methylpropyl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 62260942
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-(2-methylpropyl)cyclopropanamine
CID 115448961
[1-[[cyclopropyl(2-methylpropyl)amino]methyl]cyclopentyl]methanol
CID 62266509
N-[(4-ethyloxan-4-yl)methyl]ethanamine
CID 62907127
N-[[4-[[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]ethanamine
CID 63682561
N'-[[3-(ethylaminomethyl)oxolan-3-yl]methyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62257267
N-[[4-[[methyl(2-methylpropyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62392859
N-ethyl-2-methyl-N-[[4-[(propan-2-ylamino)methyl]oxan-4-yl]methyl]propan-1-amine
CID 62392347

Frequently Asked Questions

What is the IUPAC name of N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine?
The IUPAC name of N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine (CID 62391503) is N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine.
What is the SMILES notation for N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine?
The canonical SMILES for N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine is CCNCC1(CN(CC(C)C)C2CC2)CCOCC1.
What is the InChIKey of N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine?
The InChIKey is OGEZMBMAPXBTMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-4-17-12-16(7-9-19-10-8-16)13-18(11-14(2)3)15-5-6-15/h14-15,17H,4-13H2,1-3H3.
What are the key properties of N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine?
N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine has a molecular weight of 268.44 g/mol, XLogP of 2.51, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(ethylaminomethyl)oxan-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine is sourced from PubChem (CID 62391503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).