N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide

C13H17N5O — CID 61348905

IUPACN,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide
SMILESCN(C)C(=O)c1cc(NCc2cnn(C)c2)ccn1
InChIInChI=1S/C13H17N5O/c1-17(2)13(19)12-6-11(4-5-14-12)15-7-10-8-16-18(3)9-10/h4-6,8-9H,7H2,1-3H3,(H,14,15)
InChIKeyBEAFNIFUVNYVRE-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.13
Rot. Bonds4

About N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide

N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide (PubChem CID 61348905) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide
PubChem CID61348905
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC NameN,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide
SMILESCN(C)C(=O)c1cc(NCc2cnn(C)c2)ccn1
InChIInChI=1S/C13H17N5O/c1-17(2)13(19)12-6-11(4-5-14-12)15-7-10-8-16-18(3)9-10/h4-6,8-9H,7H2,1-3H3,(H,14,15)
InChIKeyBEAFNIFUVNYVRE-UHFFFAOYSA-N
XLogP1.13
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-3-[(1-methylpyrazol-4-yl)methylamino]benzamide
CID 43725385
4-[[4-(hydroxymethyl)phenyl]methylamino]-N,N-dimethylpyridine-2-carboxamide
CID 107232295
N,N-dimethyl-4-(1H-pyrazol-4-ylmethylamino)pyridine-2-carboxamide
CID 54897544
N,N-dimethyl-4-[(1-methylimidazol-2-yl)methylamino]pyridine-2-carboxamide
CID 63295796
N,N-dimethyl-4-[(4-methyl-3-pyridinyl)methylamino]pyridine-2-carboxamide
CID 114956582
4-[(2-amino-2-methylpropyl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 113282785
N,N-dimethyl-4-(3-pyrrolidin-1-ylpropylamino)pyridine-2-carboxamide
CID 60703987
N,N-dimethyl-4-(2-piperazin-1-ylethylamino)pyridine-2-carboxamide
CID 43600424
4-amino-N,N-dimethyl-3-[(1-methylpyrazol-4-yl)methylamino]benzamide
CID 63361195
4-(2-hydroxypropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395771
4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43517479
N,N-dimethyl-4-[(2-oxo-2-piperidin-1-ylethyl)amino]pyridine-2-carboxamide
CID 115677825

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide?
The IUPAC name of N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide (CID 61348905) is N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide is CN(C)C(=O)c1cc(NCc2cnn(C)c2)ccn1.
What is the InChIKey of N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide?
The InChIKey is BEAFNIFUVNYVRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-17(2)13(19)12-6-11(4-5-14-12)15-7-10-8-16-18(3)9-10/h4-6,8-9H,7H2,1-3H3,(H,14,15).
What are the key properties of N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide?
N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(1-methylpyrazol-4-yl)methylamino]pyridine-2-carboxamide is sourced from PubChem (CID 61348905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).