4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide

C15H18N2O2 — CID 110849428

IUPAC4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
SMILESCc1cccc2[nH]c(C(=O)NCC3CCCO3)cc12
InChIInChI=1S/C15H18N2O2/c1-10-4-2-6-13-12(10)8-14(17-13)15(18)16-9-11-5-3-7-19-11/h2,4,6,8,11,17H,3,5,7,9H2,1H3,(H,16,18)
InChIKeyOOGSWNGNCQBPHZ-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.39
Rot. Bonds3

About 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide

4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide (PubChem CID 110849428) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
PubChem CID110849428
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
SMILESCc1cccc2[nH]c(C(=O)NCC3CCCO3)cc12
InChIInChI=1S/C15H18N2O2/c1-10-4-2-6-13-12(10)8-14(17-13)15(18)16-9-11-5-3-7-19-11/h2,4,6,8,11,17H,3,5,7,9H2,1H3,(H,16,18)
InChIKeyOOGSWNGNCQBPHZ-UHFFFAOYSA-N
XLogP2.39
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methoxy-N-[[(2S)-oxolan-2-yl]methyl]-1H-indole-2-carboxamide
CID 7554172
4,6-dimethyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
CID 46521932
N-[[(2R)-oxolan-2-yl]methyl]-3H-benzo[e]indole-2-carboxamide
CID 39977666
N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
CID 2964205
3-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
CID 110849538
2-oxo-N-(oxolan-2-ylmethyl)-1H-quinoline-4-carboxamide
CID 2977759
6-bromo-N-[[(2S)-oxolan-2-yl]methyl]-1H-indole-2-carboxamide
CID 39977668
7-chloro-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
CID 110849434
N-(oxolan-2-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide
CID 3383149
4-(2-methylbenzoyl)-N-(oxolan-2-ylmethyl)-1H-pyrrole-2-carboxamide
CID 3840272
2,4,5-trimethyl-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 95970650
2,4,6-trimethyl-1-N,3-N-bis(oxolan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 3519038

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide?
The IUPAC name of 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide (CID 110849428) is 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide?
The canonical SMILES for 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide is Cc1cccc2[nH]c(C(=O)NCC3CCCO3)cc12.
What is the InChIKey of 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide?
The InChIKey is OOGSWNGNCQBPHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10-4-2-6-13-12(10)8-14(17-13)15(18)16-9-11-5-3-7-19-11/h2,4,6,8,11,17H,3,5,7,9H2,1H3,(H,16,18).
What are the key properties of 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide?
4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 110849428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).