N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine

C16H34N2O — CID 55072040

IUPACN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine
SMILESCOCCN(CC(C)CNCC(C)C)C(C)C1CC1
InChIInChI=1S/C16H34N2O/c1-13(2)10-17-11-14(3)12-18(8-9-19-5)15(4)16-6-7-16/h13-17H,6-12H2,1-5H3
InChIKeySMKQNHPLCYPHKI-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.62
Rot. Bonds11

About N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine

N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine (PubChem CID 55072040) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine
PubChem CID55072040
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC NameN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine
SMILESCOCCN(CC(C)CNCC(C)C)C(C)C1CC1
InChIInChI=1S/C16H34N2O/c1-13(2)10-17-11-14(3)12-18(8-9-19-5)15(4)16-6-7-16/h13-17H,6-12H2,1-5H3
InChIKeySMKQNHPLCYPHKI-UHFFFAOYSA-N
XLogP2.62
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 ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-cyclopropylethyl(2-methoxyethyl)amino]-2-methylpropan-1-ol
CID 115872820
1-[1-cyclopropylethyl(2-methoxyethyl)amino]-3-methoxypropan-2-ol
CID 63928354
1-cyclopropyl-N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-N-propylethane-1,2-diamine
CID 63912366
2-N-(2-methoxyethyl)-1-N,2-N-bis(2-methylpropyl)propane-1,2-diamine
CID 55074311
3-[1-cyclopropylethyl(2-methoxyethyl)amino]-2-methylpropanehydrazide
CID 63584231
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-2-methylbutane-1,4-diamine
CID 81079207
1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol
CID 103159910
3-methoxy-2-N,2-N-bis(2-methoxyethyl)-1-N-(2-methylpropyl)propane-1,2-diamine
CID 103226257
2-[1-cyclopropylethyl(2-methoxyethyl)amino]-1-(3,5-dimethylphenyl)ethanol
CID 79037102
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine
CID 62556804
1-cyclopropyl-N-(2-methoxyethyl)-N-(2-piperidin-4-yloxyethyl)ethanamine
CID 55252268
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-N-pentan-3-ylethane-1,2-diamine
CID 55089014

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine?
The IUPAC name of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine (CID 55072040) is N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine.
What is the SMILES notation for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine?
The canonical SMILES for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine is COCCN(CC(C)CNCC(C)C)C(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine?
The InChIKey is SMKQNHPLCYPHKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-13(2)10-17-11-14(3)12-18(8-9-19-5)15(4)16-6-7-16/h13-17H,6-12H2,1-5H3.
What are the key properties of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine?
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine has a molecular weight of 270.46 g/mol, XLogP of 2.62, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine is sourced from PubChem (CID 55072040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).