5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine

C15H25N — CID 65304462

IUPAC5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine
SMILESCNCCC(C)CCc1cc(C)ccc1C
InChIInChI=1S/C15H25N/c1-12(9-10-16-4)6-8-15-11-13(2)5-7-14(15)3/h5,7,11-12,16H,6,8-10H2,1-4H3
InChIKeyTYJSFIVBHMYWCI-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.48
Rot. Bonds6

About 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine

5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine (PubChem CID 65304462) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine.

Molecular Properties

Compound Name5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine
PubChem CID65304462
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine
SMILESCNCCC(C)CCc1cc(C)ccc1C
InChIInChI=1S/C15H25N/c1-12(9-10-16-4)6-8-15-11-13(2)5-7-14(15)3/h5,7,11-12,16H,6,8-10H2,1-4H3
InChIKeyTYJSFIVBHMYWCI-UHFFFAOYSA-N
XLogP3.48
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine
CID 65303647
5-(2,5-dimethylphenyl)-3-methyl-N-(2-methylpropyl)pentan-1-amine
CID 65305044
4-(2,5-dimethylphenyl)-2-methyl-N-propan-2-ylbutan-1-amine
CID 64664141
5-(3,4-diethylphenyl)-N,3-dimethylpentan-1-amine
CID 113319296
5-(5-bromo-2-methoxy-4-methylphenyl)-N,3-dimethylpentan-1-amine
CID 65433204
1-(2,5-dimethylphenyl)pentan-3-amine
CID 61481640
N-[2-(2,5-dimethylphenyl)ethyl]-2-methylbutane-1,4-diamine
CID 115202717
1-(2,5-dimethylphenyl)-N-methylmethanamine;ethane
CID 142925583
5-(4-methoxy-3-methylphenyl)-N,3-dimethylpentan-1-amine
CID 65303977
2-(3-chloro-4,4-dimethylpentyl)-1,4-dimethylbenzene
CID 63460011
1-(2,5-dimethylphenyl)hexane-3,4-diol
CID 83928188
N'-[2-(2,5-dimethylphenyl)ethyl]-N,N'-dimethylbutane-1,4-diamine
CID 115202182

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine?
The IUPAC name of 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine (CID 65304462) is 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine.
What is the SMILES notation for 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine?
The canonical SMILES for 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine is CNCCC(C)CCc1cc(C)ccc1C.
What is the InChIKey of 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine?
The InChIKey is TYJSFIVBHMYWCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-12(9-10-16-4)6-8-15-11-13(2)5-7-14(15)3/h5,7,11-12,16H,6,8-10H2,1-4H3.
What are the key properties of 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine?
5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine has a molecular weight of 219.37 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine is sourced from PubChem (CID 65304462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).