N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide

C17H25N5O2 — CID 74247767

IUPACN-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide
SMILESCNc1cc(C(=O)N(CCOC)Cc2c(C)nn(C)c2C)ccn1
InChIInChI=1S/C17H25N5O2/c1-12-15(13(2)21(4)20-12)11-22(8-9-24-5)17(23)14-6-7-19-16(10-14)18-3/h6-7,10H,8-9,11H2,1-5H3,(H,18,19)
InChIKeyUVSVDEIXBDSRTM-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.76
Rot. Bonds7

About N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide

N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide (PubChem CID 74247767) has the molecular formula C17H25N5O2 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide
PubChem CID74247767
Molecular FormulaC17H25N5O2
Molecular Weight331.42 g/mol
Exact Mass331.20
IUPAC NameN-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide
SMILESCNc1cc(C(=O)N(CCOC)Cc2c(C)nn(C)c2C)ccn1
InChIInChI=1S/C17H25N5O2/c1-12-15(13(2)21(4)20-12)11-22(8-9-24-5)17(23)14-6-7-19-16(10-14)18-3/h6-7,10H,8-9,11H2,1-5H3,(H,18,19)
InChIKeyUVSVDEIXBDSRTM-UHFFFAOYSA-N
XLogP1.76
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 79237744
N-(2-methoxyethyl)-6-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 131912052
3-[3-(dimethylamino)propyl]-1-(2-methoxyethyl)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]urea
CID 138045016
N-(2-methoxyethyl)-4-methyl-2-oxo-6-pentan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyran-3-carboxamide
CID 170506646
2-(aminomethyl)-N,N-bis(2-methoxyethyl)pyridine-4-carboxamide
CID 114325701
N-ethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]quinoline-6-carboxamide
CID 91762656
N-ethyl-N-methyl-2-(methylamino)pyridine-4-carboxamide
CID 62170484
2-chloro-N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]pyridine-4-carboxamide
CID 46988777
2-chloro-6-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 79036395
4-[bis(2-methoxyethyl)carbamoyl]pyridine-2-carboxylic acid
CID 115730064
N-(2-chloroethyl)-N-(2-methoxyethyl)-2-methylpyridine-4-carboxamide
CID 106754271
N-[(1-methylimidazol-2-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]benzamide
CID 42780924

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide (CID 74247767) is N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide is CNc1cc(C(=O)N(CCOC)Cc2c(C)nn(C)c2C)ccn1.
What is the InChIKey of N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide?
The InChIKey is UVSVDEIXBDSRTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O2/c1-12-15(13(2)21(4)20-12)11-22(8-9-24-5)17(23)14-6-7-19-16(10-14)18-3/h6-7,10H,8-9,11H2,1-5H3,(H,18,19).
What are the key properties of N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide?
N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 1.76, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 74247767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).