N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine

C15H31N — CID 130314453

IUPACN-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine
SMILESCC(C)=CC(C)(C)N(C)C(C)(C)CC(C)C
InChIInChI=1S/C15H31N/c1-12(2)10-14(5,6)16(9)15(7,8)11-13(3)4/h10,13H,11H2,1-9H3
InChIKeyYHIZWMGYJHMWMT-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.49
Rot. Bonds5

About N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine

N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine (PubChem CID 130314453) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine.

Molecular Properties

Compound NameN-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine
PubChem CID130314453
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC NameN-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine
SMILESCC(C)=CC(C)(C)N(C)C(C)(C)CC(C)C
InChIInChI=1S/C15H31N/c1-12(2)10-14(5,6)16(9)15(7,8)11-13(3)4/h10,13H,11H2,1-9H3
InChIKeyYHIZWMGYJHMWMT-UHFFFAOYSA-N
XLogP4.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N,2,4-trimethyl-N-(2-methylbutan-2-yl)pentan-2-amine
CID 88871230
N,2,4-trimethyl-N-[(2S)-3-methylbutan-2-yl]pentan-2-amine
CID 158265084
ethane;N,2,4-trimethyl-N-(3-methylbutyl)pentan-2-amine
CID 157040656
4-[[(E)-[2,4-dimethylpentan-2-yl(methyl)amino]diazenyl]-methylamino]-2,4-dimethylpentan-2-ol
CID 146437345
N,2,5-trimethyl-N-(3-methylbutyl)hexa-3,4-dien-2-amine
CID 123293577
(Z)-but-2-ene;(E)-but-2-en-2-ol;N,N-dimethylethanamine;ethane;2,2,4-trimethylpentane
CID 142052859
N,2,4-trimethyl-N-(3-methylpentyl)pentan-2-amine
CID 142386094
3,3,5-trimethylhexan-2-one
CID 2776079
N,2,3,5-tetramethylhex-1-en-3-amine
CID 145459667
(Z)-N,2,4,5,7-pentamethyl-N-propyloct-5-en-4-amine
CID 174381732
N-(2,3-dimethylbutan-2-yl)-2,4-dimethyl-N-[(3E)-penta-1,3-dien-2-yl]pentan-2-amine
CID 166671404
acetic acid;2,2,4-trimethylpentane;hydrate
CID 159555520

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine?
The IUPAC name of N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine (CID 130314453) is N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine.
What is the SMILES notation for N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine?
The canonical SMILES for N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine is CC(C)=CC(C)(C)N(C)C(C)(C)CC(C)C.
What is the InChIKey of N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine?
The InChIKey is YHIZWMGYJHMWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-12(2)10-14(5,6)16(9)15(7,8)11-13(3)4/h10,13H,11H2,1-9H3.
What are the key properties of N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine?
N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine has a molecular weight of 225.42 g/mol, XLogP of 4.49, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylpent-3-en-2-yl)-N,2,4-trimethylpentan-2-amine is sourced from PubChem (CID 130314453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).