N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine

C16H34N2O — CID 55056516

IUPACN-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine
SMILESCCCC(C)(CNC1CC1)CN(CC)C(C)COC
InChIInChI=1S/C16H34N2O/c1-6-10-16(4,12-17-15-8-9-15)13-18(7-2)14(3)11-19-5/h14-15,17H,6-13H2,1-5H3
InChIKeyFIWFZTGVKNJPNZ-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.90
Rot. Bonds11

About N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine

N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine (PubChem CID 55056516) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine
PubChem CID55056516
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC NameN-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine
SMILESCCCC(C)(CNC1CC1)CN(CC)C(C)COC
InChIInChI=1S/C16H34N2O/c1-6-10-16(4,12-17-15-8-9-15)13-18(7-2)14(3)11-19-5/h14-15,17H,6-13H2,1-5H3
InChIKeyFIWFZTGVKNJPNZ-UHFFFAOYSA-N
XLogP2.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N',2-dimethyl-N'-propan-2-yl-2-propylpropane-1,3-diamine
CID 62263755
2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol
CID 62272798
N-(5-methoxy-2-methyl-2-propylpentyl)cyclopropanamine
CID 62723418
N-[2-methyl-2-[2-(2-methylpropoxy)ethyl]pentyl]cyclopropanamine
CID 106456863
2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol
CID 64828099
N-(6-methoxy-2-methyl-2-propylhexyl)cyclopropanamine
CID 104649334
N-[2-methyl-2-(2-propan-2-yloxyethyl)pentyl]cyclopropanamine
CID 62725819
N-cyclopropyl-N',2-dimethyl-N'-(3-methylbutyl)-2-propylpropane-1,3-diamine
CID 55056498
N,N'-dicyclopropyl-N',2-dimethyl-2-propylpropane-1,3-diamine
CID 62262170
1-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-ethylamino]-2-methylpropan-2-ol
CID 79379941
N,2-diethyl-N-(1-methoxypropan-2-yl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 62255893
2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-2-methylpentanal
CID 62276222

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine?
The IUPAC name of N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine (CID 55056516) is N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine is CCCC(C)(CNC1CC1)CN(CC)C(C)COC.
What is the InChIKey of N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine?
The InChIKey is FIWFZTGVKNJPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-6-10-16(4,12-17-15-8-9-15)13-18(7-2)14(3)11-19-5/h14-15,17H,6-13H2,1-5H3.
What are the key properties of N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine?
N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine has a molecular weight of 270.46 g/mol, XLogP of 2.90, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine is sourced from PubChem (CID 55056516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).