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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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).