1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine

C16H25FN2 — CID 79396906

IUPAC1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2ccc(F)cc2)C(C)C1C
InChIInChI=1S/C16H25FN2/c1-4-10-18-16-9-11-19(13(3)12(16)2)15-7-5-14(17)6-8-15/h5-8,12-13,16,18H,4,9-11H2,1-3H3
InChIKeyKYNIAQPBAKSCCB-UHFFFAOYSA-N
MW264.39 g/mol
LogP3.43
Rot. Bonds4

About 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine

1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine (PubChem CID 79396906) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
PubChem CID79396906
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC Name1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2ccc(F)cc2)C(C)C1C
InChIInChI=1S/C16H25FN2/c1-4-10-18-16-9-11-19(13(3)12(16)2)15-7-5-14(17)6-8-15/h5-8,12-13,16,18H,4,9-11H2,1-3H3
InChIKeyKYNIAQPBAKSCCB-UHFFFAOYSA-N
XLogP3.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dimethyl-1-(4-methylphenyl)-N-propylpiperidin-4-amine
CID 79397861
1-(2-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397280
2,3-dimethyl-N-propyl-1-pyrimidin-5-ylpiperidin-4-amine
CID 107588860
1-(5-chloro-2-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79396532
1-(4-bromo-3-methoxyphenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 82858848
2,3-dimethyl-1-(3-propan-2-ylphenyl)-N-propylpiperidin-4-amine
CID 79398604
1-(2-ethylphenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397422
3-(4-fluorophenyl)-2-methyl-N-propylcyclopentan-1-amine
CID 64909010
1-(2-chlorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397876
2,3-dimethyl-1-(1-propan-2-ylpyrazol-4-yl)-N-propylpiperidin-4-amine
CID 79408053
2,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpiperidin-4-amine
CID 79779697
1-(2,4-dichlorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397728

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine?
The IUPAC name of 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine (CID 79396906) is 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine?
The canonical SMILES for 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine is CCCNC1CCN(c2ccc(F)cc2)C(C)C1C.
What is the InChIKey of 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine?
The InChIKey is KYNIAQPBAKSCCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-4-10-18-16-9-11-19(13(3)12(16)2)15-7-5-14(17)6-8-15/h5-8,12-13,16,18H,4,9-11H2,1-3H3.
What are the key properties of 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine?
1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine has a molecular weight of 264.39 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine is sourced from PubChem (CID 79396906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).