N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide

C21H17N3O — CID 99645988

IUPACN-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide
SMILESO=C(N[C@H](c1ccccc1)c1cc2ccncc2[nH]1)c1ccccc1
InChIInChI=1S/C21H17N3O/c25-21(16-9-5-2-6-10-16)24-20(15-7-3-1-4-8-15)18-13-17-11-12-22-14-19(17)23-18/h1-14,20,23H,(H,24,25)/t20-/m1/s1
InChIKeyUOXVWEUAQOTOKL-HXUWFJFHSA-N
MW327.39 g/mol
LogP4.08
Rot. Bonds4

About N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide

N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide (PubChem CID 99645988) has the molecular formula C21H17N3O and a molecular weight of 327.39 g/mol. Its IUPAC name is N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide.

Molecular Properties

Compound NameN-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide
PubChem CID99645988
Molecular FormulaC21H17N3O
Molecular Weight327.39 g/mol
Exact Mass327.14
IUPAC NameN-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide
SMILESO=C(N[C@H](c1ccccc1)c1cc2ccncc2[nH]1)c1ccccc1
InChIInChI=1S/C21H17N3O/c25-21(16-9-5-2-6-10-16)24-20(15-7-3-1-4-8-15)18-13-17-11-12-22-14-19(17)23-18/h1-14,20,23H,(H,24,25)/t20-/m1/s1
InChIKeyUOXVWEUAQOTOKL-HXUWFJFHSA-N
XLogP4.08
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(S)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]pyridine-4-carboxamide
CID 99645762
N-[2-phenyl-1-(1H-pyrrolo[2,3-c]pyridin-2-yl)ethyl]pyridine-4-carboxamide
CID 143121546
N-[(S)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
CID 92500168
N-[(4-methylphenyl)-phenylmethyl]pyridine-3-carboxamide
CID 51151137
4-methoxy-N-[phenyl(pyridin-3-yl)methyl]benzamide
CID 20896997
N-[1-benzofuran-2-yl(phenyl)methyl]pyridine-4-carboxamide
CID 42925184
3-phenylmethoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide
CID 60521820
4-methyl-N-[(6-methyl-1H-benzimidazol-2-yl)-phenylmethyl]benzamide
CID 43889998
N-[(S)-(3,4-dimethylphenyl)-phenylmethyl]pyridine-4-carboxamide
CID 26177693
N-[(3,4-dimethylphenyl)-phenylmethyl]pyridine-3-carboxamide
CID 43010004
N-[(S)-(2-methylphenyl)-phenylmethyl]pyridine-3-carboxamide
CID 100628969
N-[(4-hydroxyphenyl)-phenylmethyl]benzamide
CID 135070955

Frequently Asked Questions

What is the IUPAC name of N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide?
The IUPAC name of N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide (CID 99645988) is N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide.
What is the SMILES notation for N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide?
The canonical SMILES for N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide is O=C(N[C@H](c1ccccc1)c1cc2ccncc2[nH]1)c1ccccc1.
What is the InChIKey of N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide?
The InChIKey is UOXVWEUAQOTOKL-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H17N3O/c25-21(16-9-5-2-6-10-16)24-20(15-7-3-1-4-8-15)18-13-17-11-12-22-14-19(17)23-18/h1-14,20,23H,(H,24,25)/t20-/m1/s1.
What are the key properties of N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide?
N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide has a molecular weight of 327.39 g/mol, XLogP of 4.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide is sourced from PubChem (CID 99645988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).