N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine

C11H24N2O — CID 43137301

IUPACN'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine
SMILESCCCN(CCCN)CC1CCCO1
InChIInChI=1S/C11H24N2O/c1-2-7-13(8-4-6-12)10-11-5-3-9-14-11/h11H,2-10,12H2,1H3
InChIKeyLVAAOOGYFPUUHZ-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.23
Rot. Bonds7

About N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine

N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine (PubChem CID 43137301) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine
PubChem CID43137301
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine
SMILESCCCN(CCCN)CC1CCCO1
InChIInChI=1S/C11H24N2O/c1-2-7-13(8-4-6-12)10-11-5-3-9-14-11/h11H,2-10,12H2,1H3
InChIKeyLVAAOOGYFPUUHZ-UHFFFAOYSA-N
XLogP1.23
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-ethyl-N'-[3-(oxolan-2-yl)propyl]propane-1,3-diamine
CID 65159083
N-(3-aminopropyl)-3-[ethyl(oxolan-2-ylmethyl)amino]-N-methylpropanamide
CID 61433794
3-[heptyl(oxolan-2-ylmethyl)amino]propanoic acid
CID 82328774
N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine
CID 43591816
N'-hydroxy-2-[oxan-2-ylmethyl(propyl)amino]ethanimidamide
CID 76927473
2-methyl-3-[oxolan-2-ylmethyl(propyl)amino]propanoic acid
CID 82328121
3-[diethoxy(ethyl)silyl]-N,N-bis(oxolan-2-ylmethyl)propan-1-amine
CID 66743968
1-[(2R)-oxan-2-yl]-N,N-bis[[(2R)-oxolan-2-yl]methyl]methanamine
CID 124860098
N-methyl-N-(oxan-2-ylmethyl)propan-1-amine
CID 169307436
3-[butyl(oxolan-2-ylmethyl)amino]-2-methylpropanoic acid
CID 82328219
N'-hydroxy-2-[3-(oxolan-2-yl)propyl-propylamino]ethanimidamide
CID 77057915
N'-methyl-N'-[methyl(oxan-2-ylmethyl)sulfamoyl]propane-1,3-diamine
CID 54951890

Frequently Asked Questions

What is the IUPAC name of N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine?
The IUPAC name of N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine (CID 43137301) is N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine.
What is the SMILES notation for N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine?
The canonical SMILES for N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine is CCCN(CCCN)CC1CCCO1.
What is the InChIKey of N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine?
The InChIKey is LVAAOOGYFPUUHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-2-7-13(8-4-6-12)10-11-5-3-9-14-11/h11H,2-10,12H2,1H3.
What are the key properties of N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine?
N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine has a molecular weight of 200.33 g/mol, XLogP of 1.23, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine is sourced from PubChem (CID 43137301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).