N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine

C15H24N2 — CID 83007636

IUPACN-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine
SMILESCc1ccc(C(C)NN2CCCCC2)c(C)c1
InChIInChI=1S/C15H24N2/c1-12-7-8-15(13(2)11-12)14(3)16-17-9-5-4-6-10-17/h7-8,11,14,16H,4-6,9-10H2,1-3H3
InChIKeyFMZXOJDURHFFQE-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.35
Rot. Bonds3

About N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine

N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine (PubChem CID 83007636) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine.

Molecular Properties

Compound NameN-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine
PubChem CID83007636
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine
SMILESCc1ccc(C(C)NN2CCCCC2)c(C)c1
InChIInChI=1S/C15H24N2/c1-12-7-8-15(13(2)11-12)14(3)16-17-9-5-4-6-10-17/h7-8,11,14,16H,4-6,9-10H2,1-3H3
InChIKeyFMZXOJDURHFFQE-UHFFFAOYSA-N
XLogP3.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2,4-dimethylphenyl)ethyl]-2-piperidin-1-ylpropan-1-amine
CID 61011128
5-methyl-2-[1-[(4-methylpiperazin-1-yl)amino]ethyl]phenol
CID 83010493
5-fluoro-2-[1-(piperidin-1-ylamino)ethyl]phenol
CID 83007049
N-[(1S)-1-(2,4-dimethylphenyl)ethyl]hydroxylamine
CID 130067534
(1S)-N-[1-(2,4-dimethylphenyl)ethyl]-1-phenylethanamine
CID 81350273
N-[1-(2,4-dimethylphenyl)ethyl]-1-methylpiperidine-4-carboxamide
CID 132649676
1-[[1-(2,4-dimethylphenyl)ethylamino]methyl]cycloheptan-1-ol
CID 65122847
(3R)-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-1-methylpiperidine-3-carboxamide
CID 95396939
2-(2,4-dimethylphenyl)-2-hydroxy-1-piperidin-1-ylethanone
CID 82130939
1-(2,4-dimethylphenyl)-N-[(1-propan-2-ylcyclopropyl)methyl]ethanamine
CID 114114845
3-(azepan-1-ylsulfonyl)-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-4-methylbenzamide
CID 28635502
3-(2,4-dimethylphenyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-ol
CID 83928012

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine?
The IUPAC name of N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine (CID 83007636) is N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine.
What is the SMILES notation for N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine?
The canonical SMILES for N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine is Cc1ccc(C(C)NN2CCCCC2)c(C)c1.
What is the InChIKey of N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine?
The InChIKey is FMZXOJDURHFFQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-7-8-15(13(2)11-12)14(3)16-17-9-5-4-6-10-17/h7-8,11,14,16H,4-6,9-10H2,1-3H3.
What are the key properties of N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine?
N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dimethylphenyl)ethyl]piperidin-1-amine is sourced from PubChem (CID 83007636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).