2-N-(oxolan-2-yl)propane-1,2-diamine

C7H16N2O — CID 135236045

IUPAC2-N-(oxolan-2-yl)propane-1,2-diamine
SMILESCC(CN)NC1CCCO1
InChIInChI=1S/C7H16N2O/c1-6(5-8)9-7-3-2-4-10-7/h6-7,9H,2-5,8H2,1H3
InChIKeyAZWNWNRAHBDPCU-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.06
Rot. Bonds3

About 2-N-(oxolan-2-yl)propane-1,2-diamine

2-N-(oxolan-2-yl)propane-1,2-diamine (PubChem CID 135236045) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 2-N-(oxolan-2-yl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N-(oxolan-2-yl)propane-1,2-diamine
PubChem CID135236045
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name2-N-(oxolan-2-yl)propane-1,2-diamine
SMILESCC(CN)NC1CCCO1
InChIInChI=1S/C7H16N2O/c1-6(5-8)9-7-3-2-4-10-7/h6-7,9H,2-5,8H2,1H3
InChIKeyAZWNWNRAHBDPCU-UHFFFAOYSA-N
XLogP0.06
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-pentan-2-yloxolan-2-amine
CID 173097405
N-heptan-4-yloxolan-2-amine
CID 173097504
(2R)-2-N-[3-(oxolan-2-yl)propyl]propane-1,2-diamine
CID 104868334
1-(oxolan-2-yl)-N-propan-2-ylethane-1,2-diamine
CID 82835407
(2R)-2-(oxan-2-ylamino)propanoic acid
CID 68789041
2-(oxolan-2-ylmethylsulfanyl)propan-1-amine
CID 66242081
(2R)-2-(1,3-dioxan-2-yl)propan-1-amine
CID 94252080
N'-[1-(oxolan-2-yl)ethyl]-2-propan-2-ylpropane-1,3-diamine
CID 107441277
2-methyl-3-(oxolan-2-ylmethylsulfonyl)propan-1-amine
CID 81202083
N-methyl-1-(oxolan-2-yl)propan-2-amine
CID 60819551
(2S)-2-N-(7-bicyclo[4.1.0]heptanylmethyl)propane-1,2-diamine
CID 104867892
(2S)-2-N-[(2-methyloxolan-3-yl)methyl]propane-1,2-diamine
CID 104867499

Frequently Asked Questions

What is the IUPAC name of 2-N-(oxolan-2-yl)propane-1,2-diamine?
The IUPAC name of 2-N-(oxolan-2-yl)propane-1,2-diamine (CID 135236045) is 2-N-(oxolan-2-yl)propane-1,2-diamine.
What is the SMILES notation for 2-N-(oxolan-2-yl)propane-1,2-diamine?
The canonical SMILES for 2-N-(oxolan-2-yl)propane-1,2-diamine is CC(CN)NC1CCCO1.
What is the InChIKey of 2-N-(oxolan-2-yl)propane-1,2-diamine?
The InChIKey is AZWNWNRAHBDPCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-6(5-8)9-7-3-2-4-10-7/h6-7,9H,2-5,8H2,1H3.
What are the key properties of 2-N-(oxolan-2-yl)propane-1,2-diamine?
2-N-(oxolan-2-yl)propane-1,2-diamine has a molecular weight of 144.22 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(oxolan-2-yl)propane-1,2-diamine is sourced from PubChem (CID 135236045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).