2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride

C14H21ClN2O2 — CID 119450388

IUPAC2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride
SMILESCOc1cccc(C(C)C(=O)NC2CCNC2)c1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-10(11-4-3-5-13(8-11)18-2)14(17)16-12-6-7-15-9-12;/h3-5,8,10,12,15H,6-7,9H2,1-2H3,(H,16,17);1H
InChIKeySNARIIKCNOMZSI-UHFFFAOYSA-N
MW284.79 g/mol
LogP1.70
Rot. Bonds4

About 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride

2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride (PubChem CID 119450388) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride
PubChem CID119450388
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC Name2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride
SMILESCOc1cccc(C(C)C(=O)NC2CCNC2)c1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-10(11-4-3-5-13(8-11)18-2)14(17)16-12-6-7-15-9-12;/h3-5,8,10,12,15H,6-7,9H2,1-2H3,(H,16,17);1H
InChIKeySNARIIKCNOMZSI-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 119427977
N-[(1S)-1-(3-methoxyphenyl)ethyl]pyrrolidine-3-carboxamide
CID 81373014
2-(3-methoxyphenyl)sulfanyl-N-pyrrolidin-3-ylacetamide;hydrochloride
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2-(3-fluorophenyl)-N-piperidin-3-ylpropanamide
CID 119424683
N-piperidin-3-yl-2-(3-propan-2-ylphenoxy)propanamide;hydrochloride
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1-(3-methoxyphenyl)-3-pyrrolidin-3-ylurea
CID 61310941
2-(3-methoxyphenyl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)propanamide;hydrochloride
CID 120643744
2-naphthalen-2-yl-N-piperidin-3-ylpropanamide;hydrochloride
CID 119428640
2-(3-methoxyphenyl)-1-[4-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
CID 119560528
(3S)-3-[(1R)-1-(3-methoxyphenyl)ethyl]pyrrolidine
CID 95366455
2-(3-fluorophenoxy)-N-pyrrolidin-3-ylpropanamide
CID 119450905
N-[(1S)-1-(3-methoxyphenyl)ethyl]azepan-4-amine
CID 103982575

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride?
The IUPAC name of 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride (CID 119450388) is 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride?
The canonical SMILES for 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride is COc1cccc(C(C)C(=O)NC2CCNC2)c1.Cl.
What is the InChIKey of 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride?
The InChIKey is SNARIIKCNOMZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2.ClH/c1-10(11-4-3-5-13(8-11)18-2)14(17)16-12-6-7-15-9-12;/h3-5,8,10,12,15H,6-7,9H2,1-2H3,(H,16,17);1H.
What are the key properties of 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride?
2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride has a molecular weight of 284.79 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride is sourced from PubChem (CID 119450388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).