N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide

C20H29N3O3 — CID 91832840

IUPACN-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide
SMILESCOc1ccccc1NC(=O)CCN1CCCC(CN2CCCC2=O)C1
InChIInChI=1S/C20H29N3O3/c1-26-18-8-3-2-7-17(18)21-19(24)10-13-22-11-4-6-16(14-22)15-23-12-5-9-20(23)25/h2-3,7-8,16H,4-6,9-15H2,1H3,(H,21,24)
InChIKeyQHEPDSGORFJHNW-UHFFFAOYSA-N
MW359.47 g/mol
LogP2.36
Rot. Bonds7

About N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide

N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide (PubChem CID 91832840) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide
PubChem CID91832840
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC NameN-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide
SMILESCOc1ccccc1NC(=O)CCN1CCCC(CN2CCCC2=O)C1
InChIInChI=1S/C20H29N3O3/c1-26-18-8-3-2-7-17(18)21-19(24)10-13-22-11-4-6-16(14-22)15-23-12-5-9-20(23)25/h2-3,7-8,16H,4-6,9-15H2,1H3,(H,21,24)
InChIKeyQHEPDSGORFJHNW-UHFFFAOYSA-N
XLogP2.36
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-dimethylphenyl)-3-[(3R)-3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide
CID 124755525
N-(4-ethylphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide
CID 91843819
N-(2-chloro-4,6-dimethylphenyl)-3-[(3R)-3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide
CID 124750444
2-[3-(aminomethyl)piperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 43186953
3-(3-hydroxyazetidin-1-yl)-N-(2-methoxyphenyl)propanamide
CID 63282614
2-[3-(aminomethyl)piperidin-1-yl]-N-(2-methoxyphenyl)acetamide;hydrochloride
CID 119915836
N-(2-methoxyphenyl)-3-[(3R)-3-(thiophene-2-carbonyl)piperidin-1-yl]propanamide
CID 124749652
N-(2-methoxyphenyl)-3-[(3S)-3-(thiophene-2-carbonyl)piperidin-1-yl]propanamide
CID 124749651
3-(2,5-dioxopyrrolidin-1-yl)-N-(2-methoxyphenyl)propanamide
CID 17034881
3-[[1-(2-anilinoethyl)piperidin-3-yl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one
CID 19803529
3-[4-(cyclohexylcarbamoylamino)piperidin-1-yl]-N-(2-methoxyphenyl)propanamide
CID 56525571
N-(2-methoxyphenyl)-3-(2-oxo-1,3-thiazolidin-3-yl)propanamide
CID 18093399

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide?
The IUPAC name of N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide (CID 91832840) is N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide.
What is the SMILES notation for N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide?
The canonical SMILES for N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide is COc1ccccc1NC(=O)CCN1CCCC(CN2CCCC2=O)C1.
What is the InChIKey of N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide?
The InChIKey is QHEPDSGORFJHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3/c1-26-18-8-3-2-7-17(18)21-19(24)10-13-22-11-4-6-16(14-22)15-23-12-5-9-20(23)25/h2-3,7-8,16H,4-6,9-15H2,1H3,(H,21,24).
What are the key properties of N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide?
N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide has a molecular weight of 359.47 g/mol, XLogP of 2.36, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-3-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]propanamide is sourced from PubChem (CID 91832840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).