N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine

C14H13FN4 — CID 13264455

IUPACN-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine
SMILESCn1cnc2ccnc(NCc3ccccc3F)c21
InChIInChI=1S/C14H13FN4/c1-19-9-18-12-6-7-16-14(13(12)19)17-8-10-4-2-3-5-11(10)15/h2-7,9H,8H2,1H3,(H,16,17)
InChIKeyRFBDWLLNPKLFMF-UHFFFAOYSA-N
MW256.28 g/mol
LogP2.72
Rot. Bonds3

About N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine

N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine (PubChem CID 13264455) has the molecular formula C14H13FN4 and a molecular weight of 256.28 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine
PubChem CID13264455
Molecular FormulaC14H13FN4
Molecular Weight256.28 g/mol
Exact Mass256.11
IUPAC NameN-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine
SMILESCn1cnc2ccnc(NCc3ccccc3F)c21
InChIInChI=1S/C14H13FN4/c1-19-9-18-12-6-7-16-14(13(12)19)17-8-10-4-2-3-5-11(10)15/h2-7,9H,8H2,1H3,(H,16,17)
InChIKeyRFBDWLLNPKLFMF-UHFFFAOYSA-N
XLogP2.72
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.28
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine?
The IUPAC name of N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine (CID 13264455) is N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine is Cn1cnc2ccnc(NCc3ccccc3F)c21.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine?
The InChIKey is RFBDWLLNPKLFMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN4/c1-19-9-18-12-6-7-16-14(13(12)19)17-8-10-4-2-3-5-11(10)15/h2-7,9H,8H2,1H3,(H,16,17).
What are the key properties of N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine?
N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine has a molecular weight of 256.28 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-3-methylimidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 13264455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).