(2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide

C19H26N2O3 — CID 95235473

IUPAC(2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide
SMILESC[C@@H](OCC1CC1)C(=O)NCc1cccc(CN2CCCC2=O)c1
InChIInChI=1S/C19H26N2O3/c1-14(24-13-15-7-8-15)19(23)20-11-16-4-2-5-17(10-16)12-21-9-3-6-18(21)22/h2,4-5,10,14-15H,3,6-9,11-13H2,1H3,(H,20,23)/t14-/m1/s1
InChIKeyODPFOIITUAHMIF-CQSZACIVSA-N
MW330.43 g/mol
LogP2.24
Rot. Bonds8

About (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide

(2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide (PubChem CID 95235473) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide
PubChem CID95235473
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC Name(2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide
SMILESC[C@@H](OCC1CC1)C(=O)NCc1cccc(CN2CCCC2=O)c1
InChIInChI=1S/C19H26N2O3/c1-14(24-13-15-7-8-15)19(23)20-11-16-4-2-5-17(10-16)12-21-9-3-6-18(21)22/h2,4-5,10,14-15H,3,6-9,11-13H2,1H3,(H,20,23)/t14-/m1/s1
InChIKeyODPFOIITUAHMIF-CQSZACIVSA-N
XLogP2.24
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3-methylphenyl)methyl]-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]urea
CID 38387385
(2S)-2-amino-4-methylsulfanyl-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]butanamide;hydrochloride
CID 119285826
2-methyl-1-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-3-propan-2-ylguanidine;hydroiodide
CID 111126304
2-ethyl-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]piperidine-1-carboxamide
CID 87004700
trans-(1R,2R)-2-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 125131992
1-(1-methoxypropan-2-yl)-2-methyl-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]guanidine;hydroiodide
CID 111235468
1-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-3-[[2-(propoxymethyl)phenyl]methyl]urea
CID 78890483
2-methyl-1-(5-methylhexan-2-yl)-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]guanidine;hydroiodide
CID 111203583
3-amino-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119717021
5-amino-2-methyl-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]benzamide
CID 120621582
1-cyclopentyl-2-methyl-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]guanidine;hydroiodide
CID 110989900
1-[[2-(difluoromethoxy)phenyl]methyl]-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]urea
CID 78870413

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide?
The IUPAC name of (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide (CID 95235473) is (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide.
What is the SMILES notation for (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide?
The canonical SMILES for (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide is C[C@@H](OCC1CC1)C(=O)NCc1cccc(CN2CCCC2=O)c1.
What is the InChIKey of (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide?
The InChIKey is ODPFOIITUAHMIF-CQSZACIVSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-14(24-13-15-7-8-15)19(23)20-11-16-4-2-5-17(10-16)12-21-9-3-6-18(21)22/h2,4-5,10,14-15H,3,6-9,11-13H2,1H3,(H,20,23)/t14-/m1/s1.
What are the key properties of (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide?
(2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide has a molecular weight of 330.43 g/mol, XLogP of 2.24, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(cyclopropylmethoxy)-N-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]propanamide is sourced from PubChem (CID 95235473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).