ethane;N,2,4-trimethyl-6-propylaniline

C14H25N — CID 144922469

IUPACethane;N,2,4-trimethyl-6-propylaniline
SMILESCC.CCCc1cc(C)cc(C)c1NC
InChIInChI=1S/C12H19N.C2H6/c1-5-6-11-8-9(2)7-10(3)12(11)13-4;1-2/h7-8,13H,5-6H2,1-4H3;1-2H3
InChIKeyZGIWNGWBBCZSBZ-UHFFFAOYSA-N
MW207.36 g/mol
LogP4.32
Rot. Bonds3

About ethane;N,2,4-trimethyl-6-propylaniline

ethane;N,2,4-trimethyl-6-propylaniline (PubChem CID 144922469) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is ethane;N,2,4-trimethyl-6-propylaniline.

Molecular Properties

Compound Nameethane;N,2,4-trimethyl-6-propylaniline
PubChem CID144922469
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Nameethane;N,2,4-trimethyl-6-propylaniline
SMILESCC.CCCc1cc(C)cc(C)c1NC
InChIInChI=1S/C12H19N.C2H6/c1-5-6-11-8-9(2)7-10(3)12(11)13-4;1-2/h7-8,13H,5-6H2,1-4H3;1-2H3
InChIKeyZGIWNGWBBCZSBZ-UHFFFAOYSA-N
XLogP4.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

but-1-ene;2,4-dimethyl-1-propylbenzene;ethane
CID 165130204
1-methyl-2-(3-methyl-5-propylphenyl)hydrazine
CID 142380413
1-heptyl-2,3,5-trimethylbenzene
CID 90943000
2-ethyl-4-methyl-6-propylphenol
CID 66879780
N-ethyl-2,4,6-trimethylaniline;trichlorocobalt
CID 175492327
1,3-dimethyl-5-propylnaphthalene
CID 57064883
N-ethyl-2,6-dimethyl-4-propylaniline;formonitrile
CID 161054115
2,4-dimethyl-1-(2-propylphenyl)benzene
CID 123254969
1-methyl-3-(4-methyl-2-propylphenyl)urea
CID 151994223
2-(2,5-dimethylphenyl)-N-ethylethanamine
CID 62537525
3,6-bis(4-methyl-2,6-dipropylphenyl)pyridazine
CID 58250587
1-[3,5-dimethyl-2-(methylamino)phenyl]ethanone
CID 70302407

Frequently Asked Questions

What is the IUPAC name of ethane;N,2,4-trimethyl-6-propylaniline?
The IUPAC name of ethane;N,2,4-trimethyl-6-propylaniline (CID 144922469) is ethane;N,2,4-trimethyl-6-propylaniline.
What is the SMILES notation for ethane;N,2,4-trimethyl-6-propylaniline?
The canonical SMILES for ethane;N,2,4-trimethyl-6-propylaniline is CC.CCCc1cc(C)cc(C)c1NC.
What is the InChIKey of ethane;N,2,4-trimethyl-6-propylaniline?
The InChIKey is ZGIWNGWBBCZSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N.C2H6/c1-5-6-11-8-9(2)7-10(3)12(11)13-4;1-2/h7-8,13H,5-6H2,1-4H3;1-2H3.
What are the key properties of ethane;N,2,4-trimethyl-6-propylaniline?
ethane;N,2,4-trimethyl-6-propylaniline has a molecular weight of 207.36 g/mol, XLogP of 4.32, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N,2,4-trimethyl-6-propylaniline is sourced from PubChem (CID 144922469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).