N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide

C13H20N2O2 — CID 60682520

IUPACN-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide
SMILESCCCN(CCO)C(=O)CCc1cccnc1
InChIInChI=1S/C13H20N2O2/c1-2-8-15(9-10-16)13(17)6-5-12-4-3-7-14-11-12/h3-4,7,11,16H,2,5-6,8-10H2,1H3
InChIKeySGWYWAIZOFAJPM-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.25
Rot. Bonds7

About N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide

N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide (PubChem CID 60682520) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide
PubChem CID60682520
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide
SMILESCCCN(CCO)C(=O)CCc1cccnc1
InChIInChI=1S/C13H20N2O2/c1-2-8-15(9-10-16)13(17)6-5-12-4-3-7-14-11-12/h3-4,7,11,16H,2,5-6,8-10H2,1H3
InChIKeySGWYWAIZOFAJPM-UHFFFAOYSA-N
XLogP1.25
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-N-(2-pyridin-3-ylethyl)propanamide
CID 10262913
N-(2-hydroxyethyl)-3-(4-methylphenyl)-N-propylpropanamide
CID 60702090
N-(2-hydroxyethyl)-N-propylpyridine-3-carboxamide
CID 60670678
N-[(4-chlorophenyl)methyl]-N-pentyl-3-pyridin-3-ylpropanamide
CID 78807864
N-(piperidin-3-ylmethyl)-N-propyl-3-pyridin-3-ylpropanamide
CID 106628128
2-[2-(dimethylamino)ethyl-(3-pyridin-3-ylpropanoyl)amino]acetic acid
CID 103802557
4-hydroxy-N-methyl-N-(2-pyridin-3-ylethyl)butanamide
CID 115163161
N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide
CID 111122043
N-[2-(dimethylamino)-2-oxoethyl]-N-methyl-3-pyridin-3-ylpropanamide
CID 95903055
2-[(2-amino-2-oxoethyl)-(3-pyridin-3-ylpropanoyl)amino]acetic acid
CID 107434413
N-(2-aminoethyl)-3-phenyl-N-propylpropanamide
CID 61348391
N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide
CID 62689181

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide (CID 60682520) is N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide is CCCN(CCO)C(=O)CCc1cccnc1.
What is the InChIKey of N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide?
The InChIKey is SGWYWAIZOFAJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-2-8-15(9-10-16)13(17)6-5-12-4-3-7-14-11-12/h3-4,7,11,16H,2,5-6,8-10H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide?
N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide has a molecular weight of 236.31 g/mol, XLogP of 1.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 60682520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).