1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine

C15H30N2O — CID 63914317

IUPAC1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine
SMILESCCCNC(CN(CC)CC1CCCO1)C1CC1
InChIInChI=1S/C15H30N2O/c1-3-9-16-15(13-7-8-13)12-17(4-2)11-14-6-5-10-18-14/h13-16H,3-12H2,1-2H3
InChIKeyQYVMVEMJLYZTDV-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds9

About 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine

1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine (PubChem CID 63914317) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine
PubChem CID63914317
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine
SMILESCCCNC(CN(CC)CC1CCCO1)C1CC1
InChIInChI=1S/C15H30N2O/c1-3-9-16-15(13-7-8-13)12-17(4-2)11-14-6-5-10-18-14/h13-16H,3-12H2,1-2H3
InChIKeyQYVMVEMJLYZTDV-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N'-ethyl-N'-(2-ethylbutyl)-N-propylethane-1,2-diamine
CID 63915177
1-cyclopentyl-2-[ethyl(oxolan-2-ylmethyl)amino]ethanol
CID 104752617
1-cyclopropyl-N'-ethyl-N'-(2-methylbutyl)-N-propylethane-1,2-diamine
CID 79476656
1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 115998319
1-cyclohexyl-N',N'-bis(cyclopropylmethyl)-N-propylethane-1,2-diamine
CID 104746446
4-[ethyl(oxolan-2-ylmethyl)amino]-3-(methylamino)butan-1-ol
CID 64899466
1-cyclopropyl-N'-methyl-N'-(oxan-3-ylmethyl)-N-propylethane-1,2-diamine
CID 63913494
N,2,2-triethyl-N-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine
CID 62257104
N-[2-[ethyl(oxolan-2-ylmethyl)amino]ethyl]-N',N'-dimethylethane-1,2-diamine
CID 62554036
2-acetamido-3-[ethyl(oxolan-2-ylmethyl)amino]propanoic acid
CID 64582510
1-(oxan-3-yl)-4-(oxolan-2-yl)-N-propylbutan-1-amine
CID 65333769
3-[ethyl(oxolan-2-ylmethyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64826914

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine?
The IUPAC name of 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine (CID 63914317) is 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine.
What is the SMILES notation for 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine?
The canonical SMILES for 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine is CCCNC(CN(CC)CC1CCCO1)C1CC1.
What is the InChIKey of 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine?
The InChIKey is QYVMVEMJLYZTDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-9-16-15(13-7-8-13)12-17(4-2)11-14-6-5-10-18-14/h13-16H,3-12H2,1-2H3.
What are the key properties of 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine?
1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N'-ethyl-N'-(oxolan-2-ylmethyl)-N-propylethane-1,2-diamine is sourced from PubChem (CID 63914317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).