N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine

C12H10ClFN2 — CID 61313125

IUPACN-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine
SMILESFc1ccc(NCc2ccc(Cl)cc2)nc1
InChIInChI=1S/C12H10ClFN2/c13-10-3-1-9(2-4-10)7-15-12-6-5-11(14)8-16-12/h1-6,8H,7H2,(H,15,16)
InChIKeyRGNVVLJNYJYITP-UHFFFAOYSA-N
MW236.68 g/mol
LogP3.49
Rot. Bonds3

About N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine

N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine (PubChem CID 61313125) has the molecular formula C12H10ClFN2 and a molecular weight of 236.68 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine
PubChem CID61313125
Molecular FormulaC12H10ClFN2
Molecular Weight236.68 g/mol
Exact Mass236.05
IUPAC NameN-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine
SMILESFc1ccc(NCc2ccc(Cl)cc2)nc1
InChIInChI=1S/C12H10ClFN2/c13-10-3-1-9(2-4-10)7-15-12-6-5-11(14)8-16-12/h1-6,8H,7H2,(H,15,16)
InChIKeyRGNVVLJNYJYITP-UHFFFAOYSA-N
XLogP3.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.68
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
CID 61311584
5-chloro-N-[(3,4-difluorophenyl)methyl]pyridin-2-amine
CID 54966254
5-fluoro-N-[(6-methyl-3-pyridinyl)methyl]pyridin-2-amine
CID 62995202
4-chloro-N-[5-[(4-fluorophenyl)methylamino]-2-pyridinyl]benzenesulfonamide
CID 113027143
N-[(4-bromophenyl)methyl]-5-chloropyridin-2-amine
CID 60705114
N-[5-[(4-chlorophenyl)methylamino]-2-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113027267
N-[[4-(2-aminoethyl)phenyl]methyl]-5-chloropyridin-2-amine
CID 62503194
6-[(4-chlorophenyl)methylamino]pyridine-3-carboxylic acid
CID 28740301
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]methanesulfonamide
CID 113012323
5-fluoro-N-[(3-fluoro-4-methoxyphenyl)methyl]pyridin-2-amine
CID 83308187
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]-3-fluorobenzamide
CID 113012280
5-chloro-N-[(2,5-difluorophenyl)methyl]pyridin-2-amine
CID 55235504

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine?
The IUPAC name of N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine (CID 61313125) is N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine is Fc1ccc(NCc2ccc(Cl)cc2)nc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine?
The InChIKey is RGNVVLJNYJYITP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClFN2/c13-10-3-1-9(2-4-10)7-15-12-6-5-11(14)8-16-12/h1-6,8H,7H2,(H,15,16).
What are the key properties of N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine?
N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine has a molecular weight of 236.68 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-5-fluoropyridin-2-amine is sourced from PubChem (CID 61313125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).