N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine

C15H23FN2 — CID 54975831

IUPACN-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine
SMILESCCNC1CCN(c2cc(C)ccc2F)C(C)C1
InChIInChI=1S/C15H23FN2/c1-4-17-13-7-8-18(12(3)10-13)15-9-11(2)5-6-14(15)16/h5-6,9,12-13,17H,4,7-8,10H2,1-3H3
InChIKeyIINSVIHSJCMKCT-UHFFFAOYSA-N
MW250.36 g/mol
LogP3.10
Rot. Bonds3

About N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine

N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine (PubChem CID 54975831) has the molecular formula C15H23FN2 and a molecular weight of 250.36 g/mol. Its IUPAC name is N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine
PubChem CID54975831
Molecular FormulaC15H23FN2
Molecular Weight250.36 g/mol
Exact Mass250.18
IUPAC NameN-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine
SMILESCCNC1CCN(c2cc(C)ccc2F)C(C)C1
InChIInChI=1S/C15H23FN2/c1-4-17-13-7-8-18(12(3)10-13)15-9-11(2)5-6-14(15)16/h5-6,9,12-13,17H,4,7-8,10H2,1-3H3
InChIKeyIINSVIHSJCMKCT-UHFFFAOYSA-N
XLogP3.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-methyl-1-(3-methylphenyl)piperidin-4-amine
CID 54975435
1-(2-bromo-5-methylphenyl)-2-methyl-N-propylpiperidin-4-amine
CID 82757596
1-(4-bromo-2-methylphenyl)-N-ethyl-2-methylpiperidin-4-amine
CID 54975744
1-(2,3-dimethylphenyl)-N-ethyl-2-methylpiperidin-4-amine
CID 54975580
N-ethyl-2-methyl-1-(4-methyl-3-pyridinyl)piperidin-4-amine
CID 55202268
1-(2-chloro-4,6-difluorophenyl)-N-ethyl-2-methylpiperidin-4-amine
CID 83088384
1-[2-fluoro-5-(trifluoromethyl)phenyl]-N,2-dimethylpiperidin-4-amine
CID 63036677
N-ethyl-3-(2-fluoro-5-methylphenoxy)cyclobutan-1-amine
CID 66351826
N-ethyl-1-(2-fluorophenyl)piperidin-4-amine
CID 43315313
N-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperidin-4-amine
CID 54975441
2-(2-fluoro-5-methylphenyl)-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79931457
N-ethyl-1-(2-methoxy-5-methylphenyl)-2,3-dimethylpiperidin-4-amine
CID 79397981

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine?
The IUPAC name of N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine (CID 54975831) is N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine.
What is the SMILES notation for N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine?
The canonical SMILES for N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine is CCNC1CCN(c2cc(C)ccc2F)C(C)C1.
What is the InChIKey of N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine?
The InChIKey is IINSVIHSJCMKCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2/c1-4-17-13-7-8-18(12(3)10-13)15-9-11(2)5-6-14(15)16/h5-6,9,12-13,17H,4,7-8,10H2,1-3H3.
What are the key properties of N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine?
N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine has a molecular weight of 250.36 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-fluoro-5-methylphenyl)-2-methylpiperidin-4-amine is sourced from PubChem (CID 54975831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).