N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine

C14H15FN2 — CID 169111460

IUPACN-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine
SMILESCc1cc(F)cnc1CNCc1ccccc1
InChIInChI=1S/C14H15FN2/c1-11-7-13(15)9-17-14(11)10-16-8-12-5-3-2-4-6-12/h2-7,9,16H,8,10H2,1H3
InChIKeyIBXBBBNIHIAOGG-UHFFFAOYSA-N
MW230.29 g/mol
LogP2.82
Rot. Bonds4

About N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine

N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine (PubChem CID 169111460) has the molecular formula C14H15FN2 and a molecular weight of 230.29 g/mol. Its IUPAC name is N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine
PubChem CID169111460
Molecular FormulaC14H15FN2
Molecular Weight230.29 g/mol
Exact Mass230.12
IUPAC NameN-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine
SMILESCc1cc(F)cnc1CNCc1ccccc1
InChIInChI=1S/C14H15FN2/c1-11-7-13(15)9-17-14(11)10-16-8-12-5-3-2-4-6-12/h2-7,9,16H,8,10H2,1H3
InChIKeyIBXBBBNIHIAOGG-UHFFFAOYSA-N
XLogP2.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3,5-difluorophenyl)methyl]-1-phenylmethanamine
CID 60752788
N-[(4,6-dimethyl-3-pyridinyl)methyl]-1-phenylmethanamine
CID 130854459
1-(4-fluorophenyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]methanamine
CID 28581727
N-benzyl-1-phenylmethanamine;hydrate
CID 173452781
N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine
CID 46784169
1-(4-fluorophenyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine
CID 78978650
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine
CID 103738795
N-benzyl-1-phenylmethanamine;λ2-stannane;hydrochloride
CID 174862297
N-[(3-methyl-4-phenylmethoxyquinolin-2-yl)methyl]-1-phenylmethanamine
CID 59526922
N-benzyl-1-phenylmethanamine;1-methyl-2-[(2-methylphenyl)methyl]benzene
CID 70442876
N-[(4-chloro-3-methylphenyl)methyl]-1-phenylmethanamine
CID 103990933
1-(3-fluorophenyl)-N-[(5-methyl-1H-imidazol-2-yl)methyl]methanamine
CID 46784765

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine?
The IUPAC name of N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine (CID 169111460) is N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine.
What is the SMILES notation for N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine?
The canonical SMILES for N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine is Cc1cc(F)cnc1CNCc1ccccc1.
What is the InChIKey of N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine?
The InChIKey is IBXBBBNIHIAOGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2/c1-11-7-13(15)9-17-14(11)10-16-8-12-5-3-2-4-6-12/h2-7,9,16H,8,10H2,1H3.
What are the key properties of N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine?
N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine has a molecular weight of 230.29 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine is sourced from PubChem (CID 169111460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).