5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide

C14H21N3O3 — CID 118782526

IUPAC5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide
SMILESCOCCN1CCC(CNC(=O)c2ccc(O)cn2)C1
InChIInChI=1S/C14H21N3O3/c1-20-7-6-17-5-4-11(10-17)8-16-14(19)13-3-2-12(18)9-15-13/h2-3,9,11,18H,4-8,10H2,1H3,(H,16,19)
InChIKeyPGJNYUCOEYSKDZ-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.49
Rot. Bonds6

About 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide

5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide (PubChem CID 118782526) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide
PubChem CID118782526
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide
SMILESCOCCN1CCC(CNC(=O)c2ccc(O)cn2)C1
InChIInChI=1S/C14H21N3O3/c1-20-7-6-17-5-4-11(10-17)8-16-14(19)13-3-2-12(18)9-15-13/h2-3,9,11,18H,4-8,10H2,1H3,(H,16,19)
InChIKeyPGJNYUCOEYSKDZ-UHFFFAOYSA-N
XLogP0.49
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-bromo-N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]benzamide
CID 95238744
N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2-(methoxymethyl)benzamide
CID 95238690
N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-(1-methylimidazol-2-yl)benzamide
CID 126448828
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide
CID 71880041
N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2-(4-methylpyrazol-1-yl)acetamide
CID 91836659
N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-nitrobenzamide
CID 95293738
6-methoxy-N-[[(3R)-1-(3-methoxypropyl)pyrrolidin-3-yl]methyl]pyridine-3-carboxamide
CID 125169256
4-(1-ethylpyrazol-4-yl)-N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]benzamide
CID 125445471
5-amino-N-[(1-methylpiperidin-4-yl)methyl]pyridine-2-carboxamide
CID 81316570
N-[[(3R)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-3-(1-methylpyrazol-4-yl)propanamide
CID 129369601
2,3-dihydro-1H-inden-2-yl 4-[[(5-hydroxypyridine-2-carbonyl)amino]methyl]piperidine-1-carboxylate
CID 10178815
5-chloro-N-[[(3R)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2-nitrobenzamide
CID 95330193

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide?
The IUPAC name of 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide (CID 118782526) is 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide is COCCN1CCC(CNC(=O)c2ccc(O)cn2)C1.
What is the InChIKey of 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide?
The InChIKey is PGJNYUCOEYSKDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-20-7-6-17-5-4-11(10-17)8-16-14(19)13-3-2-12(18)9-15-13/h2-3,9,11,18H,4-8,10H2,1H3,(H,16,19).
What are the key properties of 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide?
5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 0.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 118782526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).