3,3-diethylpentan-1-amine

C9H21N — CID 15719640

IUPAC3,3-diethylpentan-1-amine
SMILESCCC(CC)(CC)CCN
InChIInChI=1S/C9H21N/c1-4-9(5-2,6-3)7-8-10/h4-8,10H2,1-3H3
InChIKeyCZZPSVORNFBYEX-UHFFFAOYSA-N
MW143.27 g/mol
LogP2.55
Rot. Bonds5

About 3,3-diethylpentan-1-amine

3,3-diethylpentan-1-amine (PubChem CID 15719640) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is 3,3-diethylpentan-1-amine.

Molecular Properties

Compound Name3,3-diethylpentan-1-amine
PubChem CID15719640
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC Name3,3-diethylpentan-1-amine
SMILESCCC(CC)(CC)CCN
InChIInChI=1S/C9H21N/c1-4-9(5-2,6-3)7-8-10/h4-8,10H2,1-3H3
InChIKeyCZZPSVORNFBYEX-UHFFFAOYSA-N
XLogP2.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.27
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3-diethylpentan-1-amine?
The IUPAC name of 3,3-diethylpentan-1-amine (CID 15719640) is 3,3-diethylpentan-1-amine.
What is the SMILES notation for 3,3-diethylpentan-1-amine?
The canonical SMILES for 3,3-diethylpentan-1-amine is CCC(CC)(CC)CCN.
What is the InChIKey of 3,3-diethylpentan-1-amine?
The InChIKey is CZZPSVORNFBYEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N/c1-4-9(5-2,6-3)7-8-10/h4-8,10H2,1-3H3.
What are the key properties of 3,3-diethylpentan-1-amine?
3,3-diethylpentan-1-amine has a molecular weight of 143.27 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethylpentan-1-amine is sourced from PubChem (CID 15719640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).