(3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one

C20H21N5O3 — CID 142797289

IUPAC(3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one
SMILESCn1nnc2cc(N3CC[C@@H](Oc4cncc(OCC5CC5)c4)C3=O)ccc21
InChIInChI=1S/C20H21N5O3/c1-24-18-5-4-14(8-17(18)22-23-24)25-7-6-19(20(25)26)28-16-9-15(10-21-11-16)27-12-13-2-3-13/h4-5,8-11,13,19H,2-3,6-7,12H2,1H3/t19-/m1/s1
InChIKeyHSUDETLHLZCMFF-LJQANCHMSA-N
MW379.42 g/mol
LogP2.34
Rot. Bonds6

About (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one

(3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one (PubChem CID 142797289) has the molecular formula C20H21N5O3 and a molecular weight of 379.42 g/mol. Its IUPAC name is (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name(3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one
PubChem CID142797289
Molecular FormulaC20H21N5O3
Molecular Weight379.42 g/mol
Exact Mass379.16
IUPAC Name(3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one
SMILESCn1nnc2cc(N3CC[C@@H](Oc4cncc(OCC5CC5)c4)C3=O)ccc21
InChIInChI=1S/C20H21N5O3/c1-24-18-5-4-14(8-17(18)22-23-24)25-7-6-19(20(25)26)28-16-9-15(10-21-11-16)27-12-13-2-3-13/h4-5,8-11,13,19H,2-3,6-7,12H2,1H3/t19-/m1/s1
InChIKeyHSUDETLHLZCMFF-LJQANCHMSA-N
XLogP2.34
TPSA82.37 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-[3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]benzotriazol-2-yl]acetic acid
CID 123455305
5-(azetidin-3-ylmethoxy)-1-methylbenzotriazole
CID 84683768
2-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-3-oxo-1H-isoindol-2-yl]acetic acid
CID 118418381
6-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-N,N,1-trimethyl-4-oxo-2,3-dihydroquinazoline-2-carboxamide
CID 118425755
methyl 2-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-1-methyl-3-oxo-1H-isoindol-2-yl]acetate
CID 118418406
2-[5-[3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-3-oxo-1H-isoindol-2-yl]-N-(2-hydroxyethyl)-N-methylacetamide
CID 123440471
2-[7-[(3R)-3-[[5-(2-cyclopropylethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-3-oxo-1H-isoindol-2-yl]-N,N-dimethylacetamide
CID 142797287
2-[3-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]-N,N-dimethylacetamide
CID 118418329
1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-3-fluoro-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide
CID 139437081
methyl 1-[5-[3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylate
CID 135306598
2-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-7-fluoro-3-oxo-1H-isoindol-2-yl]-N,N-dimethylacetamide
CID 126482608
(3R)-1-[4-(2-cyclopropylethoxy)-3-methoxyphenyl]-3-(4-phenylphenoxy)pyrrolidin-2-one
CID 144585819

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one?
The IUPAC name of (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one (CID 142797289) is (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one.
What is the SMILES notation for (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one?
The canonical SMILES for (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one is Cn1nnc2cc(N3CC[C@@H](Oc4cncc(OCC5CC5)c4)C3=O)ccc21.
What is the InChIKey of (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one?
The InChIKey is HSUDETLHLZCMFF-LJQANCHMSA-N. The full InChI is InChI=1S/C20H21N5O3/c1-24-18-5-4-14(8-17(18)22-23-24)25-7-6-19(20(25)26)28-16-9-15(10-21-11-16)27-12-13-2-3-13/h4-5,8-11,13,19H,2-3,6-7,12H2,1H3/t19-/m1/s1.
What are the key properties of (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one?
(3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one has a molecular weight of 379.42 g/mol, XLogP of 2.34, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[[5-(cyclopropylmethoxy)-3-pyridinyl]oxy]-1-(1-methylbenzotriazol-5-yl)pyrrolidin-2-one is sourced from PubChem (CID 142797289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).