N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide

C17H20N2O3 — CID 110907491

IUPACN-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
SMILESCOc1ccccc1CN(CCO)C(=O)c1ccc(C)nc1
InChIInChI=1S/C17H20N2O3/c1-13-7-8-14(11-18-13)17(21)19(9-10-20)12-15-5-3-4-6-16(15)22-2/h3-8,11,20H,9-10,12H2,1-2H3
InChIKeyHRJDXJVVXNKFJS-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.03
Rot. Bonds6

About N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide

N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide (PubChem CID 110907491) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
PubChem CID110907491
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC NameN-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
SMILESCOc1ccccc1CN(CCO)C(=O)c1ccc(C)nc1
InChIInChI=1S/C17H20N2O3/c1-13-7-8-14(11-18-13)17(21)19(9-10-20)12-15-5-3-4-6-16(15)22-2/h3-8,11,20H,9-10,12H2,1-2H3
InChIKeyHRJDXJVVXNKFJS-UHFFFAOYSA-N
XLogP2.03
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxyphenyl)methyl]-6-methyl-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 31119902
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3-(dimethylamino)-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]benzamide
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ethyl N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]carbamate
CID 64593009
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-2,5-dimethylfuran-3-carboxamide
CID 110907502
N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide
CID 123310577
2-hydroxyethyl N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]carbamate
CID 79345926
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]prop-2-enamide
CID 54875824
3-chloro-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide
CID 54875800
2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide
CID 54874200
1-(2-hydroxyethyl)-1-[(2-methoxyphenyl)methyl]-3-prop-2-enylurea
CID 110901111
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 110907482

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide (CID 110907491) is N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide is COc1ccccc1CN(CCO)C(=O)c1ccc(C)nc1.
What is the InChIKey of N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide?
The InChIKey is HRJDXJVVXNKFJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-13-7-8-14(11-18-13)17(21)19(9-10-20)12-15-5-3-4-6-16(15)22-2/h3-8,11,20H,9-10,12H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide?
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 110907491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).