N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine

C19H18FN7 — CID 169129816

IUPACN-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
SMILESF[C@H]1CNC[C@@H]1Nc1cccc(-c2cnc3cc(-c4cnc[nH]4)ccn23)n1
InChIInChI=1S/C19H18FN7/c20-13-7-21-9-16(13)26-18-3-1-2-14(25-18)17-10-23-19-6-12(4-5-27(17)19)15-8-22-11-24-15/h1-6,8,10-11,13,16,21H,7,9H2,(H,22,24)(H,25,26)/t13-,16-/m0/s1
InChIKeyLDKVUTJMMTXXEW-BBRMVZONSA-N
MW363.40 g/mol
LogP2.51
Rot. Bonds4

About N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine

N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine (PubChem CID 169129816) has the molecular formula C19H18FN7 and a molecular weight of 363.40 g/mol. Its IUPAC name is N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
PubChem CID169129816
Molecular FormulaC19H18FN7
Molecular Weight363.40 g/mol
Exact Mass363.16
IUPAC NameN-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
SMILESF[C@H]1CNC[C@@H]1Nc1cccc(-c2cnc3cc(-c4cnc[nH]4)ccn23)n1
InChIInChI=1S/C19H18FN7/c20-13-7-21-9-16(13)26-18-3-1-2-14(25-18)17-10-23-19-6-12(4-5-27(17)19)15-8-22-11-24-15/h1-6,8,10-11,13,16,21H,7,9H2,(H,22,24)(H,25,26)/t13-,16-/m0/s1
InChIKeyLDKVUTJMMTXXEW-BBRMVZONSA-N
XLogP2.51
TPSA82.93 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.40
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(2H-triazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
CID 169129425
6-(7-cyclopropylimidazo[1,2-a]pyridin-3-yl)-N-[(3S,4S)-4-fluoropyrrolidin-3-yl]pyridin-2-amine
CID 166961776
3-fluoropyrrolidine;6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
CID 169129908
6-[7-[(Z)-2-amino-1-hydrazinylethenyl]imidazo[1,2-a]pyridin-3-yl]-N-(4-fluoropyrrolidin-3-yl)pyridin-2-amine
CID 169129832
[3-[6-[[(3S,4S)-4-fluoropyrrolidin-3-yl]amino]pyrazin-2-yl]imidazo[1,2-a]pyridin-7-yl]methanol
CID 176741112
6-(7-cyclopropyloxyimidazo[1,2-a]pyridin-3-yl)-N-(4-fluoropiperidin-3-yl)pyridin-2-amine
CID 169129599
N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine
CID 58303378
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
6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-[(3S,4S)-4-fluoropiperidin-3-yl]pyridin-2-amine
CID 166961592
3-[6-[[(3S,4S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-N,N-dimethylimidazo[1,2-b]pyridazin-6-amine
CID 167122374
1-[3-[6-[(4-fluoropyrrolidin-3-yl)amino]-2-pyridinyl]-7-methoxyimidazo[1,2-a]pyridin-6-yl]pyrrolidin-2-one
CID 169129615
(2R)-1,1,1-trifluoro-2-[3-[6-[[(3S,4S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyrazin-6-yl]propan-2-ol
CID 167137335

Frequently Asked Questions

What is the IUPAC name of N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine?
The IUPAC name of N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine (CID 169129816) is N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine.
What is the SMILES notation for N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine?
The canonical SMILES for N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine is F[C@H]1CNC[C@@H]1Nc1cccc(-c2cnc3cc(-c4cnc[nH]4)ccn23)n1.
What is the InChIKey of N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine?
The InChIKey is LDKVUTJMMTXXEW-BBRMVZONSA-N. The full InChI is InChI=1S/C19H18FN7/c20-13-7-21-9-16(13)26-18-3-1-2-14(25-18)17-10-23-19-6-12(4-5-27(17)19)15-8-22-11-24-15/h1-6,8,10-11,13,16,21H,7,9H2,(H,22,24)(H,25,26)/t13-,16-/m0/s1.
What are the key properties of N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine?
N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine has a molecular weight of 363.40 g/mol, XLogP of 2.51, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-[7-(1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine is sourced from PubChem (CID 169129816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).