4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine

C15H25N — CID 64718536

IUPAC4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
SMILESCCNC(C)CC(C)c1cc(C)ccc1C
InChIInChI=1S/C15H25N/c1-6-16-14(5)10-13(4)15-9-11(2)7-8-12(15)3/h7-9,13-14,16H,6,10H2,1-5H3
InChIKeyKDVJRPKLQDYUHV-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.80
Rot. Bonds5

About 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine

4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine (PubChem CID 64718536) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine.

Molecular Properties

Compound Name4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
PubChem CID64718536
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
SMILESCCNC(C)CC(C)c1cc(C)ccc1C
InChIInChI=1S/C15H25N/c1-6-16-14(5)10-13(4)15-9-11(2)7-8-12(15)3/h7-9,13-14,16H,6,10H2,1-5H3
InChIKeyKDVJRPKLQDYUHV-UHFFFAOYSA-N
XLogP3.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,5-dimethylphenyl)-N-ethylpropan-1-amine
CID 43490783
1-(2,5-dimethylphenyl)-N-ethyl-4-methylpentan-1-amine
CID 43490798
CID 136852898
CID 136852898
1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine
CID 66437881
2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)acetic acid
CID 54977951
N-[(2,5-dimethylphenyl)-(3,4-dimethylphenyl)methyl]ethanamine
CID 43487964
1-(2,5-dimethylphenyl)-N-ethyl-2-(3-methylbutan-2-ylsulfanyl)ethanamine
CID 107763423
1-(2,5-dimethylphenyl)-N-ethyl-2-pentan-2-yloxyethanamine
CID 102981309
1-(2,5-dimethylphenyl)-N-ethyl-2-[2-(2-methylpropoxy)ethoxy]ethanamine
CID 106447347
N-[(2,5-dimethylphenyl)-(4-fluorophenyl)methyl]ethanamine
CID 43488838
4-(4-methyl-3-pyridinyl)-N-propylpentan-2-amine
CID 66272751
1-(2,5-dimethylphenyl)-N-ethyl-2-methylsulfonylethanamine
CID 55110466

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine?
The IUPAC name of 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine (CID 64718536) is 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine.
What is the SMILES notation for 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine?
The canonical SMILES for 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine is CCNC(C)CC(C)c1cc(C)ccc1C.
What is the InChIKey of 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine?
The InChIKey is KDVJRPKLQDYUHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-6-16-14(5)10-13(4)15-9-11(2)7-8-12(15)3/h7-9,13-14,16H,6,10H2,1-5H3.
What are the key properties of 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine?
4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine has a molecular weight of 219.37 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine is sourced from PubChem (CID 64718536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).