N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide

C15H21N5O — CID 62176856

IUPACN-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)N(C)Cc2cnn(C)c2)cn1
InChIInChI=1S/C15H21N5O/c1-4-7-16-14-6-5-13(9-17-14)15(21)19(2)10-12-8-18-20(3)11-12/h5-6,8-9,11H,4,7,10H2,1-3H3,(H,16,17)
InChIKeyKCZLPJZUJCMVOW-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.91
Rot. Bonds6

About N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide

N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide (PubChem CID 62176856) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
PubChem CID62176856
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)N(C)Cc2cnn(C)c2)cn1
InChIInChI=1S/C15H21N5O/c1-4-7-16-14-6-5-13(9-17-14)15(21)19(2)10-12-8-18-20(3)11-12/h5-6,8-9,11H,4,7,10H2,1-3H3,(H,16,17)
InChIKeyKCZLPJZUJCMVOW-UHFFFAOYSA-N
XLogP1.91
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-6-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 63208830
N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide
CID 55046985
N-benzyl-6-(butylamino)-N-methylpyridine-3-carboxamide
CID 109151561
N-methyl-6-(propylamino)-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109151190
N-ethyl-6-[3-(1-methylpyrazol-4-yl)propylamino]pyridine-3-carboxamide
CID 135096608
5-chloro-6-(ethylamino)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 62177921
4-amino-N,3-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 54905633
3,5-diamino-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 61139345
3-amino-4-chloro-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 54905632
N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine
CID 62208787
4-[5-(dimethylamino)-1-ethyl-1,2,4-triazol-3-yl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 122569858
4-(ethylamino)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 81240912

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide (CID 62176856) is N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide is CCCNc1ccc(C(=O)N(C)Cc2cnn(C)c2)cn1.
What is the InChIKey of N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is KCZLPJZUJCMVOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-4-7-16-14-6-5-13(9-17-14)15(21)19(2)10-12-8-18-20(3)11-12/h5-6,8-9,11H,4,7,10H2,1-3H3,(H,16,17).
What are the key properties of N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide?
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62176856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).