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

C9H21N — CID 20714825

IUPACN,2,4,4-tetramethylpentan-2-amine
SMILESCNC(C)(C)CC(C)(C)C
InChIInChI=1S/C9H21N/c1-8(2,3)7-9(4,5)10-6/h10H,7H2,1-6H3
InChIKeyGSIDBWUSWHJWQS-UHFFFAOYSA-N
MW143.27 g/mol
LogP2.42
Rot. Bonds2

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

N,2,4,4-tetramethylpentan-2-amine (PubChem CID 20714825) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is N,2,4,4-tetramethylpentan-2-amine.

Molecular Properties

Compound NameN,2,4,4-tetramethylpentan-2-amine
PubChem CID20714825
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC NameN,2,4,4-tetramethylpentan-2-amine
SMILESCNC(C)(C)CC(C)(C)C
InChIInChI=1S/C9H21N/c1-8(2,3)7-9(4,5)10-6/h10H,7H2,1-6H3
InChIKeyGSIDBWUSWHJWQS-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.27
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,2,4,4-tetramethylpentan-2-amine?
The IUPAC name of N,2,4,4-tetramethylpentan-2-amine (CID 20714825) is N,2,4,4-tetramethylpentan-2-amine.
What is the SMILES notation for N,2,4,4-tetramethylpentan-2-amine?
The canonical SMILES for N,2,4,4-tetramethylpentan-2-amine is CNC(C)(C)CC(C)(C)C.
What is the InChIKey of N,2,4,4-tetramethylpentan-2-amine?
The InChIKey is GSIDBWUSWHJWQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N/c1-8(2,3)7-9(4,5)10-6/h10H,7H2,1-6H3.
What are the key properties of N,2,4,4-tetramethylpentan-2-amine?
N,2,4,4-tetramethylpentan-2-amine has a molecular weight of 143.27 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,4,4-tetramethylpentan-2-amine is sourced from PubChem (CID 20714825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).