N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide

C12H19N3O2 — CID 55046985

IUPACN-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)N(C)CCO)cn1
InChIInChI=1S/C12H19N3O2/c1-3-6-13-11-5-4-10(9-14-11)12(17)15(2)7-8-16/h4-5,9,16H,3,6-8H2,1-2H3,(H,13,14)
InChIKeyJZYKNOWPAISATF-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.97
Rot. Bonds6

About N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide

N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide (PubChem CID 55046985) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide
PubChem CID55046985
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)N(C)CCO)cn1
InChIInChI=1S/C12H19N3O2/c1-3-6-13-11-5-4-10(9-14-11)12(17)15(2)7-8-16/h4-5,9,16H,3,6-8H2,1-2H3,(H,13,14)
InChIKeyJZYKNOWPAISATF-UHFFFAOYSA-N
XLogP0.97
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyethyl)-N-propyl-6-(propylamino)pyridine-3-carboxamide
CID 55046804
N-methyl-6-(propylamino)-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109151190
N-butyl-6-[3-(dimethylamino)propylamino]-N-methylpyridine-3-carboxamide
CID 109154268
6-(ethylamino)-N-methyl-N-propylpyridine-3-carboxamide
CID 62167941
N-methyl-6-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 63208830
N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide
CID 62177310
5-chloro-N-(2-hydroxyethyl)-N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 114922484
N-propan-2-yl-N-propyl-6-(propylamino)pyridine-3-carboxamide
CID 62168280
N-[3-(dimethylamino)propyl]-6-(ethylamino)-N-methylpyridine-3-carboxamide
CID 55226022
N',N'-dimethyl-6-(propylamino)pyridine-3-carbohydrazide
CID 83024179
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
CID 62176856
6-[2-(dimethylamino)ethylamino]-N,N-dipropylpyridine-3-carboxamide
CID 109153775

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide (CID 55046985) is N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide is CCCNc1ccc(C(=O)N(C)CCO)cn1.
What is the InChIKey of N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is JZYKNOWPAISATF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-3-6-13-11-5-4-10(9-14-11)12(17)15(2)7-8-16/h4-5,9,16H,3,6-8H2,1-2H3,(H,13,14).
What are the key properties of N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide?
N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 237.30 g/mol, XLogP of 0.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 55046985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).