1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide

C19H25N3O2 — CID 91841039

IUPAC1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide
SMILESCn1c(C(=O)N[C@H]2COC[C@@H]2N2CCCCC2)cc2ccccc21
InChIInChI=1S/C19H25N3O2/c1-21-16-8-4-3-7-14(16)11-17(21)19(23)20-15-12-24-13-18(15)22-9-5-2-6-10-22/h3-4,7-8,11,15,18H,2,5-6,9-10,12-13H2,1H3,(H,20,23)/t15-,18-/m0/s1
InChIKeyVQDRBPNMELJNLV-YJBOKZPZSA-N
MW327.43 g/mol
LogP2.16
Rot. Bonds3

About 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide

1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide (PubChem CID 91841039) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide
PubChem CID91841039
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide
SMILESCn1c(C(=O)N[C@H]2COC[C@@H]2N2CCCCC2)cc2ccccc21
InChIInChI=1S/C19H25N3O2/c1-21-16-8-4-3-7-14(16)11-17(21)19(23)20-15-12-24-13-18(15)22-9-5-2-6-10-22/h3-4,7-8,11,15,18H,2,5-6,9-10,12-13H2,1H3,(H,20,23)/t15-,18-/m0/s1
InChIKeyVQDRBPNMELJNLV-YJBOKZPZSA-N
XLogP2.16
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3R,4S)-4-hydroxyoxolan-3-yl]-1-methylindole-2-carboxamide
CID 133268385
2-[(1-methylindole-2-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 23510298
1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-4-carboxamide
CID 118788686
5-hydroxy-1,2-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]indole-3-carboxamide
CID 91841298
1-naphthalen-2-yl-3-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]urea
CID 133138704
1-methyl-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]indole-2-carboxamide
CID 91765488
5-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,2-oxazole-3-carboxamide
CID 122556576
5-acetyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]thiophene-2-carboxamide
CID 118790643
1-methyl-N-(4-piperidin-1-ylphenyl)indole-2-carboxamide
CID 60527502
2,4-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1,3-oxazole-5-carboxamide
CID 122565102
2-cyano-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]benzamide
CID 118781498
7-chloro-N-(4-hydroxyoxolan-3-yl)-1-methylindole-2-carboxamide
CID 156607520

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide?
The IUPAC name of 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide (CID 91841039) is 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide.
What is the SMILES notation for 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide?
The canonical SMILES for 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide is Cn1c(C(=O)N[C@H]2COC[C@@H]2N2CCCCC2)cc2ccccc21.
What is the InChIKey of 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide?
The InChIKey is VQDRBPNMELJNLV-YJBOKZPZSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-21-16-8-4-3-7-14(16)11-17(21)19(23)20-15-12-24-13-18(15)22-9-5-2-6-10-22/h3-4,7-8,11,15,18H,2,5-6,9-10,12-13H2,1H3,(H,20,23)/t15-,18-/m0/s1.
What are the key properties of 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide?
1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide is sourced from PubChem (CID 91841039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).