N,2,4,4-tetramethylhexan-3-amine

C10H23N — CID 90896439

IUPACN,2,4,4-tetramethylhexan-3-amine
SMILESCCC(C)(C)C(NC)C(C)C
InChIInChI=1S/C10H23N/c1-7-10(4,5)9(11-6)8(2)3/h8-9,11H,7H2,1-6H3
InChIKeyDMNGOCOBPZJROP-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.67
Rot. Bonds4

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

N,2,4,4-tetramethylhexan-3-amine (PubChem CID 90896439) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is N,2,4,4-tetramethylhexan-3-amine.

Molecular Properties

Compound NameN,2,4,4-tetramethylhexan-3-amine
PubChem CID90896439
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC NameN,2,4,4-tetramethylhexan-3-amine
SMILESCCC(C)(C)C(NC)C(C)C
InChIInChI=1S/C10H23N/c1-7-10(4,5)9(11-6)8(2)3/h8-9,11H,7H2,1-6H3
InChIKeyDMNGOCOBPZJROP-UHFFFAOYSA-N
XLogP2.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.67
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-tetramethylhexan-3-amine?
The IUPAC name of N,2,4,4-tetramethylhexan-3-amine (CID 90896439) is N,2,4,4-tetramethylhexan-3-amine.
What is the SMILES notation for N,2,4,4-tetramethylhexan-3-amine?
The canonical SMILES for N,2,4,4-tetramethylhexan-3-amine is CCC(C)(C)C(NC)C(C)C.
What is the InChIKey of N,2,4,4-tetramethylhexan-3-amine?
The InChIKey is DMNGOCOBPZJROP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N/c1-7-10(4,5)9(11-6)8(2)3/h8-9,11H,7H2,1-6H3.
What are the key properties of N,2,4,4-tetramethylhexan-3-amine?
N,2,4,4-tetramethylhexan-3-amine has a molecular weight of 157.30 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,4,4-tetramethylhexan-3-amine is sourced from PubChem (CID 90896439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).