N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide

C11H17N3O2 — CID 81240291

IUPACN-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)N(C)CC(C)O
InChIInChI=1S/C11H17N3O2/c1-8(15)7-14(3)11(16)9-6-13-5-4-10(9)12-2/h4-6,8,15H,7H2,1-3H3,(H,12,13)
InChIKeyDNLLZNCCDQCNPN-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.58
Rot. Bonds4

About N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide

N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide (PubChem CID 81240291) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide
PubChem CID81240291
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)N(C)CC(C)O
InChIInChI=1S/C11H17N3O2/c1-8(15)7-14(3)11(16)9-6-13-5-4-10(9)12-2/h4-6,8,15H,7H2,1-3H3,(H,12,13)
InChIKeyDNLLZNCCDQCNPN-UHFFFAOYSA-N
XLogP0.58
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-4-(methylamino)-N-(2-methylbutyl)pyridine-3-carboxamide
CID 81236054
N-(1-methoxypropan-2-yl)-N-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81242683
N-[1-(dimethylamino)propan-2-yl]-4-(methylamino)pyridine-3-carboxamide
CID 82949883
N-[(4-methoxyphenyl)methyl]-N-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81237935
N-methyl-4-(methylamino)-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 81241836
4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
CID 81240413
4-hydrazinyl-N-(2-hydroxyethyl)-N-methylpyridine-3-carboxamide
CID 81256357
N-(2,3-dimethylbutyl)-4-(methylamino)pyridine-3-carboxamide
CID 81245145
N-[4-(dimethylamino)butan-2-yl]-4-(methylamino)pyridine-3-carboxamide
CID 81239916
N-(2-cyanoethyl)-4-hydrazinyl-N-methylpyridine-3-carboxamide
CID 81255891
N-[(3-cyanophenyl)methyl]-N-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81238313
4-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide
CID 81249131

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide (CID 81240291) is N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide is CNc1ccncc1C(=O)N(C)CC(C)O.
What is the InChIKey of N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide?
The InChIKey is DNLLZNCCDQCNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8(15)7-14(3)11(16)9-6-13-5-4-10(9)12-2/h4-6,8,15H,7H2,1-3H3,(H,12,13).
What are the key properties of N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide?
N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81240291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).