1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine

C11H15ClFN3 — CID 115313515

IUPAC1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine
SMILESCC1CC(N)CCN1c1ncc(Cl)cc1F
InChIInChI=1S/C11H15ClFN3/c1-7-4-9(14)2-3-16(7)11-10(13)5-8(12)6-15-11/h5-7,9H,2-4,14H2,1H3
InChIKeyZHYDPFNRHOPDAL-UHFFFAOYSA-N
MW243.71 g/mol
LogP2.19
Rot. Bonds1

About 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine

1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine (PubChem CID 115313515) has the molecular formula C11H15ClFN3 and a molecular weight of 243.71 g/mol. Its IUPAC name is 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine
PubChem CID115313515
Molecular FormulaC11H15ClFN3
Molecular Weight243.71 g/mol
Exact Mass243.09
IUPAC Name1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine
SMILESCC1CC(N)CCN1c1ncc(Cl)cc1F
InChIInChI=1S/C11H15ClFN3/c1-7-4-9(14)2-3-16(7)11-10(13)5-8(12)6-15-11/h5-7,9H,2-4,14H2,1H3
InChIKeyZHYDPFNRHOPDAL-UHFFFAOYSA-N
XLogP2.19
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.71
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-3-fluoro-2-(2-methylpyrrolidin-1-yl)pyridine
CID 79728793
4-(5-chloro-3-fluoro-2-pyridinyl)-3-methylmorpholine
CID 79727473
1-(5-chloro-3-fluoro-2-pyridinyl)-3-methylpiperidin-4-amine
CID 79867696
5-chloro-3-fluoro-2-(2-propan-2-ylpyrrolidin-1-yl)pyridine
CID 79727902
5-bromo-2-(2,4-dimethylpiperidin-1-yl)-3-fluoropyridine
CID 104924417
5-chloro-3-fluoro-2-(4-propan-2-ylpiperidin-1-yl)pyridine
CID 58431434
[1-(5-chloro-3-fluoro-2-pyridinyl)pyrrolidin-2-yl]methanol
CID 79727661
1-(5-bromopyrimidin-2-yl)-2-methylpiperidin-4-amine
CID 115313485
1-[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-2-yl]-N-methylmethanamine
CID 79728781
2-methyl-1-quinazolin-4-ylpiperidin-4-amine
CID 66801029
[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-2-yl]methanol
CID 79727255
2-(4-bromo-3-methylpiperidin-1-yl)-5-chloro-3-fluoropyridine
CID 114682797

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine?
The IUPAC name of 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine (CID 115313515) is 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine.
What is the SMILES notation for 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine?
The canonical SMILES for 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine is CC1CC(N)CCN1c1ncc(Cl)cc1F.
What is the InChIKey of 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine?
The InChIKey is ZHYDPFNRHOPDAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClFN3/c1-7-4-9(14)2-3-16(7)11-10(13)5-8(12)6-15-11/h5-7,9H,2-4,14H2,1H3.
What are the key properties of 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine?
1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine has a molecular weight of 243.71 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-3-fluoro-2-pyridinyl)-2-methylpiperidin-4-amine is sourced from PubChem (CID 115313515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).