6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide

C16H21N5O2 — CID 129367054

IUPAC6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide
SMILESC[C@@H](CNC(=O)c1ccc(-n2ccnc2)nc1)N1CCOCC1
InChIInChI=1S/C16H21N5O2/c1-13(20-6-8-23-9-7-20)10-19-16(22)14-2-3-15(18-11-14)21-5-4-17-12-21/h2-5,11-13H,6-10H2,1H3,(H,19,22)/t13-/m0/s1
InChIKeyVQDMIIFBIVIRJP-ZDUSSCGKSA-N
MW315.38 g/mol
LogP0.72
Rot. Bonds5

About 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide

6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide (PubChem CID 129367054) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide
PubChem CID129367054
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide
SMILESC[C@@H](CNC(=O)c1ccc(-n2ccnc2)nc1)N1CCOCC1
InChIInChI=1S/C16H21N5O2/c1-13(20-6-8-23-9-7-20)10-19-16(22)14-2-3-15(18-11-14)21-5-4-17-12-21/h2-5,11-13H,6-10H2,1H3,(H,19,22)/t13-/m0/s1
InChIKeyVQDMIIFBIVIRJP-ZDUSSCGKSA-N
XLogP0.72
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152181
6-imidazol-1-yl-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)pyridine-3-carboxamide
CID 120811031
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 94184782
N-[(2S)-3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 94031928
N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152532
N-[(2R)-2-morpholin-4-ylpropyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 94022187
6-imidazol-1-yl-N-(2-methylsulfanylethyl)pyridine-3-carboxamide
CID 23594782
ethane;6-imidazol-1-yl-N-methylpyridine-3-carboxamide
CID 142231779
2-[(6-imidazol-1-ylpyridine-3-carbonyl)amino]propanoic acid
CID 43355195
N-(2-benzyl-3-hydroxypropyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 146088860
3-[(6-imidazol-1-ylpyridine-3-carbonyl)amino]-2,2-dimethylpropanoic acid
CID 115427337
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 79246612

Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide?
The IUPAC name of 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide (CID 129367054) is 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide?
The canonical SMILES for 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide is C[C@@H](CNC(=O)c1ccc(-n2ccnc2)nc1)N1CCOCC1.
What is the InChIKey of 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide?
The InChIKey is VQDMIIFBIVIRJP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-13(20-6-8-23-9-7-20)10-19-16(22)14-2-3-15(18-11-14)21-5-4-17-12-21/h2-5,11-13H,6-10H2,1H3,(H,19,22)/t13-/m0/s1.
What are the key properties of 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide?
6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide has a molecular weight of 315.38 g/mol, XLogP of 0.72, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide is sourced from PubChem (CID 129367054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).