N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide

C14H15N5O — CID 171432749

IUPACN-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide
SMILESCc1cc2cnc(NC(=O)c3cnn(C)c3)cc2n1C
InChIInChI=1S/C14H15N5O/c1-9-4-10-6-15-13(5-12(10)19(9)3)17-14(20)11-7-16-18(2)8-11/h4-8H,1-3H3,(H,15,17,20)
InChIKeyNKKLRGRIDQJTIM-UHFFFAOYSA-N
MW269.31 g/mol
LogP1.87
Rot. Bonds2

About N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide

N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide (PubChem CID 171432749) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide
PubChem CID171432749
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC NameN-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide
SMILESCc1cc2cnc(NC(=O)c3cnn(C)c3)cc2n1C
InChIInChI=1S/C14H15N5O/c1-9-4-10-6-15-13(5-12(10)19(9)3)17-14(20)11-7-16-18(2)8-11/h4-8H,1-3H3,(H,15,17,20)
InChIKeyNKKLRGRIDQJTIM-UHFFFAOYSA-N
XLogP1.87
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-bromo-4-methyl-2-pyridinyl)-1-methylpyrazole-4-carboxamide
CID 79729400
N-[2-[2-(ethylamino)pyrimidin-4-yl]-1-methylpyrrolo[3,2-c]pyridin-6-yl]-1-methylpyrazole-4-carboxamide
CID 171432733
1-methyl-N-(2-pyridin-3-yl-1H-pyrrolo[3,2-c]pyridin-6-yl)pyrazole-4-carboxamide
CID 169097850
1-methyl-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]indazole-5-carboxamide
CID 138590174
ethyl 3-[[2-[(1-methylpyrazole-4-carbonyl)amino]-4-pyridinyl]oxy]benzoate
CID 176905513
1-methyl-N-[2-[2-(1,2,2-trifluoroethoxy)pyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-6-yl]pyrazole-4-carboxamide
CID 175479516
1-methyl-N-(1-methylimidazol-2-yl)pyrazole-4-carboxamide
CID 110471391
1-methyl-N-(4-methyl-1H-pyrazol-5-yl)pyrazole-4-carboxamide
CID 112691443
1-methyl-N-(trifluoromethyl)pyrazole-4-carboxamide
CID 91041717
N-(3,5-dichloro-4-hydroxyphenyl)-1-methylpyrazole-4-carboxamide
CID 82885113
N-(2-bromo-5-methylphenyl)-1-methylpyrazole-4-carboxamide
CID 82757494
N-(2-chloro-4,6-dimethylphenyl)-1-methylpyrazole-4-carboxamide
CID 110695870

Frequently Asked Questions

What is the IUPAC name of N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide?
The IUPAC name of N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide (CID 171432749) is N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide.
What is the SMILES notation for N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide?
The canonical SMILES for N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide is Cc1cc2cnc(NC(=O)c3cnn(C)c3)cc2n1C.
What is the InChIKey of N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide?
The InChIKey is NKKLRGRIDQJTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-9-4-10-6-15-13(5-12(10)19(9)3)17-14(20)11-7-16-18(2)8-11/h4-8H,1-3H3,(H,15,17,20).
What are the key properties of N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide?
N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide has a molecular weight of 269.31 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dimethylpyrrolo[3,2-c]pyridin-6-yl)-1-methylpyrazole-4-carboxamide is sourced from PubChem (CID 171432749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).