3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine

C10H22N2O — CID 18674574

IUPAC3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine
SMILESNCCCC1(CCCN)CCCO1
InChIInChI=1S/C10H22N2O/c11-7-1-4-10(5-2-8-12)6-3-9-13-10/h1-9,11-12H2
InChIKeyYXANQODBWVXFHG-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.01
Rot. Bonds6

About 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine

3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine (PubChem CID 18674574) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine.

Molecular Properties

Compound Name3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine
PubChem CID18674574
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine
SMILESNCCCC1(CCCN)CCCO1
InChIInChI=1S/C10H22N2O/c11-7-1-4-10(5-2-8-12)6-3-9-13-10/h1-9,11-12H2
InChIKeyYXANQODBWVXFHG-UHFFFAOYSA-N
XLogP1.01
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine?
The IUPAC name of 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine (CID 18674574) is 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine.
What is the SMILES notation for 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine?
The canonical SMILES for 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine is NCCCC1(CCCN)CCCO1.
What is the InChIKey of 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine?
The InChIKey is YXANQODBWVXFHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c11-7-1-4-10(5-2-8-12)6-3-9-13-10/h1-9,11-12H2.
What are the key properties of 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine?
3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine has a molecular weight of 186.30 g/mol, XLogP of 1.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-aminopropyl)oxolan-2-yl]propan-1-amine is sourced from PubChem (CID 18674574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).