N,N,2,4-tetramethylpentan-3-amine

C9H21N — CID 6453029

IUPACN,N,2,4-tetramethylpentan-3-amine
SMILESCC(C)C(C(C)C)N(C)C
InChIInChI=1S/C9H21N/c1-7(2)9(8(3)4)10(5)6/h7-9H,1-6H3
InChIKeySWIVDNYSVCBPDH-UHFFFAOYSA-N
MW143.27 g/mol
LogP2.23
Rot. Bonds3

About N,N,2,4-tetramethylpentan-3-amine

N,N,2,4-tetramethylpentan-3-amine (PubChem CID 6453029) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is N,N,2,4-tetramethylpentan-3-amine.

Molecular Properties

Compound NameN,N,2,4-tetramethylpentan-3-amine
PubChem CID6453029
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC NameN,N,2,4-tetramethylpentan-3-amine
SMILESCC(C)C(C(C)C)N(C)C
InChIInChI=1S/C9H21N/c1-7(2)9(8(3)4)10(5)6/h7-9H,1-6H3
InChIKeySWIVDNYSVCBPDH-UHFFFAOYSA-N
XLogP2.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.27
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,N,2,4-tetramethylpentan-3-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N,2,4-tetramethylpentan-3-amine?
The IUPAC name of N,N,2,4-tetramethylpentan-3-amine (CID 6453029) is N,N,2,4-tetramethylpentan-3-amine.
What is the SMILES notation for N,N,2,4-tetramethylpentan-3-amine?
The canonical SMILES for N,N,2,4-tetramethylpentan-3-amine is CC(C)C(C(C)C)N(C)C.
What is the InChIKey of N,N,2,4-tetramethylpentan-3-amine?
The InChIKey is SWIVDNYSVCBPDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N/c1-7(2)9(8(3)4)10(5)6/h7-9H,1-6H3.
What are the key properties of N,N,2,4-tetramethylpentan-3-amine?
N,N,2,4-tetramethylpentan-3-amine has a molecular weight of 143.27 g/mol, XLogP of 2.23, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,4-tetramethylpentan-3-amine is sourced from PubChem (CID 6453029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).