N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine

C19H15FN4 — CID 71729576

IUPACN-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine
SMILESCn1c(-c2cccnc2)cc2c(Nc3ccc(F)cc3)nccc21
InChIInChI=1S/C19H15FN4/c1-24-17-8-10-22-19(23-15-6-4-14(20)5-7-15)16(17)11-18(24)13-3-2-9-21-12-13/h2-12H,1H3,(H,22,23)
InChIKeyDIOSSPTYONVMCQ-UHFFFAOYSA-N
MW318.36 g/mol
LogP4.52
Rot. Bonds3

About N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine

N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine (PubChem CID 71729576) has the molecular formula C19H15FN4 and a molecular weight of 318.36 g/mol. Its IUPAC name is N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine
PubChem CID71729576
Molecular FormulaC19H15FN4
Molecular Weight318.36 g/mol
Exact Mass318.13
IUPAC NameN-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine
SMILESCn1c(-c2cccnc2)cc2c(Nc3ccc(F)cc3)nccc21
InChIInChI=1S/C19H15FN4/c1-24-17-8-10-22-19(23-15-6-4-14(20)5-7-15)16(17)11-18(24)13-3-2-9-21-12-13/h2-12H,1H3,(H,22,23)
InChIKeyDIOSSPTYONVMCQ-UHFFFAOYSA-N
XLogP4.52
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.36
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine?
The IUPAC name of N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine (CID 71729576) is N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine is Cn1c(-c2cccnc2)cc2c(Nc3ccc(F)cc3)nccc21.
What is the InChIKey of N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine?
The InChIKey is DIOSSPTYONVMCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4/c1-24-17-8-10-22-19(23-15-6-4-14(20)5-7-15)16(17)11-18(24)13-3-2-9-21-12-13/h2-12H,1H3,(H,22,23).
What are the key properties of N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine?
N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine has a molecular weight of 318.36 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-1-methyl-2-pyridin-3-ylpyrrolo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 71729576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).