1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine

C12H26N2O — CID 16792709

IUPAC1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine
SMILESCCCN(CCC)C(CN)C1CCOC1
InChIInChI=1S/C12H26N2O/c1-3-6-14(7-4-2)12(9-13)11-5-8-15-10-11/h11-12H,3-10,13H2,1-2H3
InChIKeyMAVMBZITIPSSLZ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.47
Rot. Bonds7

About 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine

1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine (PubChem CID 16792709) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine.

Molecular Properties

Compound Name1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine
PubChem CID16792709
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine
SMILESCCCN(CCC)C(CN)C1CCOC1
InChIInChI=1S/C12H26N2O/c1-3-6-14(7-4-2)12(9-13)11-5-8-15-10-11/h11-12H,3-10,13H2,1-2H3
InChIKeyMAVMBZITIPSSLZ-UHFFFAOYSA-N
XLogP1.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-bis(2-methylpropyl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 61377686
N-butyl-N-ethyl-1-(oxan-4-yl)ethane-1,2-diamine
CID 62386855
N-cyclopropyl-1-(oxan-4-yl)-N-propylethane-1,2-diamine
CID 62386127
N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 63982239
1-cyclopropyl-N-ethyl-N-propylethane-1,2-diamine
CID 43655040
N-(cyclopropylmethyl)-N-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 60984338
N-(2-methylpropyl)-1-(oxolan-3-yl)-N-pentan-3-ylethane-1,2-diamine
CID 79483273
N-ethyl-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 61423393
N'-methyl-1-(oxolan-3-yl)-N'-propylethane-1,2-diamine
CID 104744694
2-(2,2-dimethylhydrazinyl)-2-(oxolan-3-yl)ethanamine
CID 83010989
N-methyl-N-(oxan-2-ylmethyl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 61431092
N-butan-2-yl-N-butyl-1-(oxan-4-yl)ethane-1,2-diamine
CID 62385415

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine?
The IUPAC name of 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine (CID 16792709) is 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine.
What is the SMILES notation for 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine?
The canonical SMILES for 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine is CCCN(CCC)C(CN)C1CCOC1.
What is the InChIKey of 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine?
The InChIKey is MAVMBZITIPSSLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-3-6-14(7-4-2)12(9-13)11-5-8-15-10-11/h11-12H,3-10,13H2,1-2H3.
What are the key properties of 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine?
1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine has a molecular weight of 214.35 g/mol, XLogP of 1.47, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine is sourced from PubChem (CID 16792709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).