6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide

C12H15N5O — CID 47351026

IUPAC6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide
SMILESCN(C)c1ccc(C(=O)NCc2ccn[nH]2)cn1
InChIInChI=1S/C12H15N5O/c1-17(2)11-4-3-9(7-13-11)12(18)14-8-10-5-6-15-16-10/h3-7H,8H2,1-2H3,(H,14,18)(H,15,16)
InChIKeyHOLCKRUJUPTTQI-UHFFFAOYSA-N
MW245.29 g/mol
LogP0.80
Rot. Bonds4

About 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide

6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide (PubChem CID 47351026) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide
PubChem CID47351026
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide
SMILESCN(C)c1ccc(C(=O)NCc2ccn[nH]2)cn1
InChIInChI=1S/C12H15N5O/c1-17(2)11-4-3-9(7-13-11)12(18)14-8-10-5-6-15-16-10/h3-7H,8H2,1-2H3,(H,14,18)(H,15,16)
InChIKeyHOLCKRUJUPTTQI-UHFFFAOYSA-N
XLogP0.80
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-pyrazol-5-ylmethyl)-1H-pyrazole-4-carboxamide
CID 60975279
4-iodo-N-(1H-pyrazol-5-ylmethyl)benzamide
CID 47204233
4-(2,2-dimethylpropyl)-N-(1H-pyrazol-5-ylmethyl)benzamide
CID 137435463
6-(dimethylamino)-N-[(2-pyrazol-1-ylphenyl)methyl]pyridine-3-carboxamide
CID 51095820
6-(dimethylamino)-N-[[3-[(dimethylamino)methyl]phenyl]methyl]pyridine-3-carboxamide
CID 37273166
6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120828209
5-methyl-N-(1H-pyrazol-5-ylmethyl)pyrazine-2-carboxamide
CID 47285811
N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide
CID 119996612
6-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopropyl]methyl]pyridine-3-carboxamide
CID 80707921
6-(dimethylamino)-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-carboxamide
CID 111445550
N-(3-aminobutyl)-6-(dimethylamino)pyridine-3-carboxamide
CID 119497031
6-(dimethylamino)-N-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]pyridine-3-carboxamide
CID 78861696

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide (CID 47351026) is 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide is CN(C)c1ccc(C(=O)NCc2ccn[nH]2)cn1.
What is the InChIKey of 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide?
The InChIKey is HOLCKRUJUPTTQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-17(2)11-4-3-9(7-13-11)12(18)14-8-10-5-6-15-16-10/h3-7H,8H2,1-2H3,(H,14,18)(H,15,16).
What are the key properties of 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide?
6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide has a molecular weight of 245.29 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-N-(1H-pyrazol-5-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 47351026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).