5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide

C20H23N5O2 — CID 129315869

IUPAC5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide
SMILESCc1nc(-c2cc(-c3cncc(C(=O)N(C)CCCO)c3)ccn2)[nH]c1C
InChIInChI=1S/C20H23N5O2/c1-13-14(2)24-19(23-13)18-10-15(5-6-22-18)16-9-17(12-21-11-16)20(27)25(3)7-4-8-26/h5-6,9-12,26H,4,7-8H2,1-3H3,(H,23,24)
InChIKeySFFQRXFCYRHFEB-UHFFFAOYSA-N
MW365.44 g/mol
LogP2.60
Rot. Bonds6

About 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide

5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide (PubChem CID 129315869) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide
PubChem CID129315869
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC Name5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide
SMILESCc1nc(-c2cc(-c3cncc(C(=O)N(C)CCCO)c3)ccn2)[nH]c1C
InChIInChI=1S/C20H23N5O2/c1-13-14(2)24-19(23-13)18-10-15(5-6-22-18)16-9-17(12-21-11-16)20(27)25(3)7-4-8-26/h5-6,9-12,26H,4,7-8H2,1-3H3,(H,23,24)
InChIKeySFFQRXFCYRHFEB-UHFFFAOYSA-N
XLogP2.60
TPSA95.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide with MolForge

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Related Compounds

2-(Difluoromethyl)-5-{[(2-Methylpropanoyl)amino]methyl}-N-{5-Methyl-4-[4-(Trifluoromethyl)phenyl]-1h-Imidazol-2-Yl}pyridine-3-Carboxamide
CID 71059525
Linaprazan
CID 9951066
2-(2-aminopyrimidin-4-yl)-7-(propan-2-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-one
CID 11357740
2-[2-(Oxan-4-Ylamino)pyrimidin-4-Yl]-5-(Phenylmethyl)-6,7-Dihydro-1~{h}-Pyrrolo[3,2-C]pyridin-4-One
CID 126480560
Dipyridodiazepinone deriv. 41
CID 463561
Dipyridodiazepinone deriv. 42
CID 463562
Dipyridodiazepinone deriv. 43
CID 463563
2-ethyl-9-methyl-13-(2-phenylethyl)-5-(1H-pyrrol-2-yl)-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one
CID 470743
GSK-3beta Inhibitor XI
CID 10020713
2-(2-aminopyrimidin-4-yl)-7-phenyl-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-one
CID 11210036
2-[2-(benzylamino)pyrimidin-4-yl]-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-one
CID 11267154
2-[2-(phenylamino)pyrimidin-4-yl]-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-one
CID 11267850

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide?
The IUPAC name of 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide (CID 129315869) is 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide is Cc1nc(-c2cc(-c3cncc(C(=O)N(C)CCCO)c3)ccn2)[nH]c1C.
What is the InChIKey of 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide?
The InChIKey is SFFQRXFCYRHFEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c1-13-14(2)24-19(23-13)18-10-15(5-6-22-18)16-9-17(12-21-11-16)20(27)25(3)7-4-8-26/h5-6,9-12,26H,4,7-8H2,1-3H3,(H,23,24).
What are the key properties of 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide?
5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide has a molecular weight of 365.44 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4,5-dimethyl-1H-imidazol-2-yl)-4-pyridinyl]-N-(3-hydroxypropyl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 129315869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).