5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide

C19H25N3O3 — CID 91841298

IUPAC5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide
SMILESCc1c(C(=O)N[C@H]2COC[C@@H]2N2CCCC2)c2cc(O)ccc2n1C
InChIInChI=1S/C19H25N3O3/c1-12-18(14-9-13(23)5-6-16(14)21(12)2)19(24)20-15-10-25-11-17(15)22-7-3-4-8-22/h5-6,9,15,17,23H,3-4,7-8,10-11H2,1-2H3,(H,20,24)/t15-,17-/m0/s1
InChIKeyOBGDATKGDCHCGM-RDJZCZTQSA-N
MW343.43 g/mol
LogP1.79
Rot. Bonds3

About 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide

5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide (PubChem CID 91841298) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide
PubChem CID91841298
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide
SMILESCc1c(C(=O)N[C@H]2COC[C@@H]2N2CCCC2)c2cc(O)ccc2n1C
InChIInChI=1S/C19H25N3O3/c1-12-18(14-9-13(23)5-6-16(14)21(12)2)19(24)20-15-10-25-11-17(15)22-7-3-4-8-22/h5-6,9,15,17,23H,3-4,7-8,10-11H2,1-2H3,(H,20,24)/t15-,17-/m0/s1
InChIKeyOBGDATKGDCHCGM-RDJZCZTQSA-N
XLogP1.79
TPSA66.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide with MolForge

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Related Compounds

N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-hydroxy-1,2-dimethylindole-3-carboxamide
CID 124753319
1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide
CID 91841039
N-[(3R,4R)-4-hydroxyoxan-3-yl]-5-methoxy-1,2-dimethylindole-3-carboxamide
CID 91791830
4-hydroxy-2-methyl-5-propan-2-yl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]benzamide
CID 154854972
5-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,2-oxazole-3-carboxamide
CID 122556576
1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-4-carboxamide
CID 118788686
5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide
CID 91789169
5-acetyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]thiophene-2-carboxamide
CID 118790643
2-amino-6-methyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]pyrimidine-4-carboxamide
CID 118778494
2,4-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1,3-oxazole-5-carboxamide
CID 122565102
5-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-oxazole-4-carboxamide
CID 122559298
2,6-dimethyl-N-[(3R,4R)-4-morpholin-4-yloxolan-3-yl]pyridine-3-carboxamide
CID 122571640

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide?
The IUPAC name of 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide (CID 91841298) is 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide.
What is the SMILES notation for 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide?
The canonical SMILES for 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide is Cc1c(C(=O)N[C@H]2COC[C@@H]2N2CCCC2)c2cc(O)ccc2n1C.
What is the InChIKey of 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide?
The InChIKey is OBGDATKGDCHCGM-RDJZCZTQSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-12-18(14-9-13(23)5-6-16(14)21(12)2)19(24)20-15-10-25-11-17(15)22-7-3-4-8-22/h5-6,9,15,17,23H,3-4,7-8,10-11H2,1-2H3,(H,20,24)/t15-,17-/m0/s1.
What are the key properties of 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide?
5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide is sourced from PubChem (CID 91841298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).