3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea

C15H18FN5O — CID 129340336

IUPAC3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea
SMILESCN(C[C@H]1CCn2ccnc2C1)C(=O)Nc1ccc(F)cn1
InChIInChI=1S/C15H18FN5O/c1-20(15(22)19-13-3-2-12(16)9-18-13)10-11-4-6-21-7-5-17-14(21)8-11/h2-3,5,7,9,11H,4,6,8,10H2,1H3,(H,18,19,22)/t11-/m0/s1
InChIKeyXDDCLBUQHRFQTM-NSHDSACASA-N
MW303.34 g/mol
LogP2.14
Rot. Bonds3

About 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea

3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea (PubChem CID 129340336) has the molecular formula C15H18FN5O and a molecular weight of 303.34 g/mol. Its IUPAC name is 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea.

Molecular Properties

Compound Name3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea
PubChem CID129340336
Molecular FormulaC15H18FN5O
Molecular Weight303.34 g/mol
Exact Mass303.15
IUPAC Name3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea
SMILESCN(C[C@H]1CCn2ccnc2C1)C(=O)Nc1ccc(F)cn1
InChIInChI=1S/C15H18FN5O/c1-20(15(22)19-13-3-2-12(16)9-18-13)10-11-4-6-21-7-5-17-14(21)8-11/h2-3,5,7,9,11H,4,6,8,10H2,1H3,(H,18,19,22)/t11-/m0/s1
InChIKeyXDDCLBUQHRFQTM-NSHDSACASA-N
XLogP2.14
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea with MolForge

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

Launch Full Analysis

Related Compounds

3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea
CID 129340335
1-methyl-3-(4-methyl-2-pyridinyl)-1-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea
CID 129329759
1-methyl-3-(4-methyl-1,2-oxazol-3-yl)-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea
CID 129328569
N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)pyridine-3-carboxamide
CID 128993290
N-methyl-2-(2-oxo-1-pyridinyl)-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide
CID 129328998
N,2-dimethyl-6-oxo-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-pyridine-3-carboxamide
CID 129333972
3-(5-fluoro-2-pyridinyl)-1-methyl-1-(1-methylpyrrolidin-3-yl)urea
CID 154764943
N,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]furan-2-carboxamide
CID 129337216
N-methyl-5-propyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-pyrazole-4-carboxamide
CID 129334705
2-cyclohexyloxy-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide
CID 129333684
N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indazole-5-carboxamide
CID 129340487
N-methyl-1-[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanamine
CID 98013239

Frequently Asked Questions

What is the IUPAC name of 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea?
The IUPAC name of 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea (CID 129340336) is 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea.
What is the SMILES notation for 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea?
The canonical SMILES for 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea is CN(C[C@H]1CCn2ccnc2C1)C(=O)Nc1ccc(F)cn1.
What is the InChIKey of 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea?
The InChIKey is XDDCLBUQHRFQTM-NSHDSACASA-N. The full InChI is InChI=1S/C15H18FN5O/c1-20(15(22)19-13-3-2-12(16)9-18-13)10-11-4-6-21-7-5-17-14(21)8-11/h2-3,5,7,9,11H,4,6,8,10H2,1H3,(H,18,19,22)/t11-/m0/s1.
What are the key properties of 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea?
3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea has a molecular weight of 303.34 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluoro-2-pyridinyl)-1-methyl-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea is sourced from PubChem (CID 129340336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).