2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide

C11H17N3O2 — CID 111113305

IUPAC2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide
SMILESCN(CCO)CC(=O)NCc1cccnc1
InChIInChI=1S/C11H17N3O2/c1-14(5-6-15)9-11(16)13-8-10-3-2-4-12-7-10/h2-4,7,15H,5-6,8-9H2,1H3,(H,13,16)
InChIKeyLFKQISHVVHSFTC-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.38
Rot. Bonds6

About 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide

2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 111113305) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide
PubChem CID111113305
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide
SMILESCN(CCO)CC(=O)NCc1cccnc1
InChIInChI=1S/C11H17N3O2/c1-14(5-6-15)9-11(16)13-8-10-3-2-4-12-7-10/h2-4,7,15H,5-6,8-9H2,1H3,(H,13,16)
InChIKeyLFKQISHVVHSFTC-UHFFFAOYSA-N
XLogP-0.38
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-(pyridin-3-ylmethyl)acetamide
CID 113160421
2-[methyl-[2-(1-methylpiperidin-2-yl)ethyl]amino]-N-(pyridin-3-ylmethyl)acetamide
CID 71988848
2-[acetyl(pyridin-3-ylmethyl)amino]-N-(pyridin-3-ylmethyl)acetamide
CID 113163586
2-(N-acetylanilino)-N-(pyridin-3-ylmethyl)acetamide
CID 113167103
2-[2-hydroxyethyl(methyl)amino]-N-(quinolin-4-ylmethyl)acetamide
CID 91795310
2-[acetyl-[(4-methylphenyl)methyl]amino]-N-(pyridin-3-ylmethyl)acetamide
CID 113161783
3-(dipropylamino)-N-(pyridin-3-ylmethyl)propanamide
CID 109023509
N-(2,1,3-benzoxadiazol-5-ylmethyl)-2-[methyl(pyridin-3-ylmethyl)amino]acetamide
CID 91762097
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(pyridin-3-ylmethyl)acetamide
CID 1073007
2-[3,4-dihydro-1H-isochromen-1-ylmethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide
CID 75370672
2-[(4-chlorophenyl)methyl-methylsulfonylamino]-N-(pyridin-3-ylmethyl)acetamide
CID 2230213
2-[methyl-[(1R,2R)-2-methylsulfanylcyclopentyl]amino]-N-(pyridin-3-ylmethyl)acetamide
CID 99106879

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide (CID 111113305) is 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide is CN(CCO)CC(=O)NCc1cccnc1.
What is the InChIKey of 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is LFKQISHVVHSFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-14(5-6-15)9-11(16)13-8-10-3-2-4-12-7-10/h2-4,7,15H,5-6,8-9H2,1H3,(H,13,16).
What are the key properties of 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide?
2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 223.28 g/mol, XLogP of -0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(methyl)amino]-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 111113305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).