N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide

C15H23N3O2 — CID 95842714

IUPACN-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide
SMILESCN1CCC[C@@H]1c1cccc(CCC(=O)NCCO)n1
InChIInChI=1S/C15H23N3O2/c1-18-10-3-6-14(18)13-5-2-4-12(17-13)7-8-15(20)16-9-11-19/h2,4-5,14,19H,3,6-11H2,1H3,(H,16,20)/t14-/m1/s1
InChIKeyHMDSZMFLESSTTQ-CQSZACIVSA-N
MW277.37 g/mol
LogP0.89
Rot. Bonds6

About N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide

N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide (PubChem CID 95842714) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide
PubChem CID95842714
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide
SMILESCN1CCC[C@@H]1c1cccc(CCC(=O)NCCO)n1
InChIInChI=1S/C15H23N3O2/c1-18-10-3-6-14(18)13-5-2-4-12(17-13)7-8-15(20)16-9-11-19/h2,4-5,14,19H,3,6-11H2,1H3,(H,16,20)/t14-/m1/s1
InChIKeyHMDSZMFLESSTTQ-CQSZACIVSA-N
XLogP0.89
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide
CID 110269727
N-methyl-3-[6-(1-propan-2-ylpyrrolidin-2-yl)-2-pyridinyl]propanamide
CID 110269724
N-(2-amino-2-oxoethyl)-3-[6-(1-methylpiperidin-3-yl)-2-pyridinyl]propanamide
CID 110258164
2-[(2-fluorophenyl)methyl]-6-(1-methylpyrrolidin-2-yl)pyridine
CID 110254376
3-[6-[(2S)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-yl]-2-pyridinyl]propanoic acid
CID 124973545
2-[(4-fluorophenyl)methyl]-6-(1-methylpyrrolidin-2-yl)pyridine
CID 110254377
6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
CID 124980249
3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide
CID 95820731
2-bromo-6-[(2R)-1-methylpyrrolidin-2-yl]pyridine
CID 124641952
4-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]benzoic acid
CID 124987095
3-[6-[(3S)-1-methylpiperidin-3-yl]-2-pyridinyl]propanoic acid
CID 95804855
2-[3-[2-methyl-6-[(2R)-1-methylpyrrolidin-2-yl]-4-pyridinyl]propanoylamino]acetic acid
CID 95827134

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide?
The IUPAC name of N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide (CID 95842714) is N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide?
The canonical SMILES for N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide is CN1CCC[C@@H]1c1cccc(CCC(=O)NCCO)n1.
What is the InChIKey of N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide?
The InChIKey is HMDSZMFLESSTTQ-CQSZACIVSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-18-10-3-6-14(18)13-5-2-4-12(17-13)7-8-15(20)16-9-11-19/h2,4-5,14,19H,3,6-11H2,1H3,(H,16,20)/t14-/m1/s1.
What are the key properties of N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide?
N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide has a molecular weight of 277.37 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide is sourced from PubChem (CID 95842714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).