N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine

C20H20FN7 — CID 166961718

IUPACN-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
SMILESCn1cc(-c2ccc3ncc(-c4cccc(N[C@@H]5CNC[C@@H]5F)n4)n3c2)cn1
InChIInChI=1S/C20H20FN7/c1-27-11-14(7-24-27)13-5-6-20-23-10-18(28(20)12-13)16-3-2-4-19(25-16)26-17-9-22-8-15(17)21/h2-7,10-12,15,17,22H,8-9H2,1H3,(H,25,26)/t15-,17+/m0/s1
InChIKeyRMKCHWNCFUKDKZ-DOTOQJQBSA-N
MW377.43 g/mol
LogP2.52
Rot. Bonds4

About N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine

N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine (PubChem CID 166961718) has the molecular formula C20H20FN7 and a molecular weight of 377.43 g/mol. Its IUPAC name is N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
PubChem CID166961718
Molecular FormulaC20H20FN7
Molecular Weight377.43 g/mol
Exact Mass377.18
IUPAC NameN-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
SMILESCn1cc(-c2ccc3ncc(-c4cccc(N[C@@H]5CNC[C@@H]5F)n4)n3c2)cn1
InChIInChI=1S/C20H20FN7/c1-27-11-14(7-24-27)13-5-6-20-23-10-18(28(20)12-13)16-3-2-4-19(25-16)26-17-9-22-8-15(17)21/h2-7,10-12,15,17,22H,8-9H2,1H3,(H,25,26)/t15-,17+/m0/s1
InChIKeyRMKCHWNCFUKDKZ-DOTOQJQBSA-N
XLogP2.52
TPSA72.07 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.43
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine?
The IUPAC name of N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine (CID 166961718) is N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine.
What is the SMILES notation for N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine?
The canonical SMILES for N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine is Cn1cc(-c2ccc3ncc(-c4cccc(N[C@@H]5CNC[C@@H]5F)n4)n3c2)cn1.
What is the InChIKey of N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine?
The InChIKey is RMKCHWNCFUKDKZ-DOTOQJQBSA-N. The full InChI is InChI=1S/C20H20FN7/c1-27-11-14(7-24-27)13-5-6-20-23-10-18(28(20)12-13)16-3-2-4-19(25-16)26-17-9-22-8-15(17)21/h2-7,10-12,15,17,22H,8-9H2,1H3,(H,25,26)/t15-,17+/m0/s1.
What are the key properties of N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine?
N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine has a molecular weight of 377.43 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine is sourced from PubChem (CID 166961718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).