N,N,2,4-tetramethylpentan-1-amine

C9H21N — CID 58758115

IUPACN,N,2,4-tetramethylpentan-1-amine
SMILESCC(C)CC(C)CN(C)C
InChIInChI=1S/C9H21N/c1-8(2)6-9(3)7-10(4)5/h8-9H,6-7H2,1-5H3
InChIKeyVCSNSZCOTPOLQG-UHFFFAOYSA-N
MW143.27 g/mol
LogP2.23
Rot. Bonds4

About N,N,2,4-tetramethylpentan-1-amine

N,N,2,4-tetramethylpentan-1-amine (PubChem CID 58758115) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is N,N,2,4-tetramethylpentan-1-amine.

Molecular Properties

Compound NameN,N,2,4-tetramethylpentan-1-amine
PubChem CID58758115
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC NameN,N,2,4-tetramethylpentan-1-amine
SMILESCC(C)CC(C)CN(C)C
InChIInChI=1S/C9H21N/c1-8(2)6-9(3)7-10(4)5/h8-9H,6-7H2,1-5H3
InChIKeyVCSNSZCOTPOLQG-UHFFFAOYSA-N
XLogP2.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
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-1-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-1-amine?
The IUPAC name of N,N,2,4-tetramethylpentan-1-amine (CID 58758115) is N,N,2,4-tetramethylpentan-1-amine.
What is the SMILES notation for N,N,2,4-tetramethylpentan-1-amine?
The canonical SMILES for N,N,2,4-tetramethylpentan-1-amine is CC(C)CC(C)CN(C)C.
What is the InChIKey of N,N,2,4-tetramethylpentan-1-amine?
The InChIKey is VCSNSZCOTPOLQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N/c1-8(2)6-9(3)7-10(4)5/h8-9H,6-7H2,1-5H3.
What are the key properties of N,N,2,4-tetramethylpentan-1-amine?
N,N,2,4-tetramethylpentan-1-amine has a molecular weight of 143.27 g/mol, XLogP of 2.23, 4 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-1-amine is sourced from PubChem (CID 58758115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).