1-(2,5-dimethylphenyl)-N-methylpentan-1-amine

C14H23N — CID 43483753

IUPAC1-(2,5-dimethylphenyl)-N-methylpentan-1-amine
SMILESCCCCC(NC)c1cc(C)ccc1C
InChIInChI=1S/C14H23N/c1-5-6-7-14(15-4)13-10-11(2)8-9-12(13)3/h8-10,14-15H,5-7H2,1-4H3
InChIKeyDTVBUIZPUNYLNC-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.75
Rot. Bonds5

About 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine

1-(2,5-dimethylphenyl)-N-methylpentan-1-amine (PubChem CID 43483753) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-N-methylpentan-1-amine
PubChem CID43483753
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name1-(2,5-dimethylphenyl)-N-methylpentan-1-amine
SMILESCCCCC(NC)c1cc(C)ccc1C
InChIInChI=1S/C14H23N/c1-5-6-7-14(15-4)13-10-11(2)8-9-12(13)3/h8-10,14-15H,5-7H2,1-4H3
InChIKeyDTVBUIZPUNYLNC-UHFFFAOYSA-N
XLogP3.75
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,5-dimethylphenyl)-N-methylpropan-1-amine
CID 43483756
1-(2,5-dimethylphenyl)-N-methyl-3-propoxypropan-1-amine
CID 105120142
1-(2-ethoxy-5-methylphenyl)-N-methylpentan-1-amine
CID 62302323
3-(2,5-dimethylphenyl)-3-(methylamino)propan-1-ol
CID 64812187
1-(2,4-dimethylphenyl)-N-methylundecan-1-amine
CID 115845807
5-(2,5-dimethylphenyl)-5-(methylamino)pentanoic acid
CID 116953082
1-(2,5-dimethylphenyl)-N-methyl-4-phenylbutan-1-amine
CID 115849503
1-(2-fluoro-5-methylphenyl)-N-methylhexan-1-amine
CID 115837280
1-(2,5-dimethylphenyl)-N-methyl-3-(4-methylphenyl)propan-1-amine
CID 105120019
1-(5-chloro-2-methylphenyl)-N-methylundecan-1-amine
CID 115845912
1-(5-chloro-2-methylphenyl)-N-methylnonan-1-amine
CID 115835500
1-(5-bromo-2-methylphenyl)-N-methylheptan-1-amine
CID 115833849

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine?
The IUPAC name of 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine (CID 43483753) is 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine?
The canonical SMILES for 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine is CCCCC(NC)c1cc(C)ccc1C.
What is the InChIKey of 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine?
The InChIKey is DTVBUIZPUNYLNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-5-6-7-14(15-4)13-10-11(2)8-9-12(13)3/h8-10,14-15H,5-7H2,1-4H3.
What are the key properties of 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine?
1-(2,5-dimethylphenyl)-N-methylpentan-1-amine has a molecular weight of 205.34 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylphenyl)-N-methylpentan-1-amine is sourced from PubChem (CID 43483753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).