N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide

C15H20N2O2 — CID 6934364

IUPACN-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide
SMILESCOC[C@H](C)NC(=O)c1cc2c(C)cc(C)cc2[nH]1
InChIInChI=1S/C15H20N2O2/c1-9-5-10(2)12-7-14(17-13(12)6-9)15(18)16-11(3)8-19-4/h5-7,11,17H,8H2,1-4H3,(H,16,18)/t11-/m0/s1
InChIKeyRFCKCNDROWSTTF-NSHDSACASA-N
MW260.34 g/mol
LogP2.55
Rot. Bonds4

About N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide

N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide (PubChem CID 6934364) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide
PubChem CID6934364
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide
SMILESCOC[C@H](C)NC(=O)c1cc2c(C)cc(C)cc2[nH]1
InChIInChI=1S/C15H20N2O2/c1-9-5-10(2)12-7-14(17-13(12)6-9)15(18)16-11(3)8-19-4/h5-7,11,17H,8H2,1-4H3,(H,16,18)/t11-/m0/s1
InChIKeyRFCKCNDROWSTTF-NSHDSACASA-N
XLogP2.55
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methoxypropan-2-yl)-4,6-dimethyl-1H-indole-2-carboxamide
CID 2823670
4,6-dimethyl-N-[1-oxo-1-(propylamino)propan-2-yl]-1H-indole-2-carboxamide
CID 46420954
4,6-dimethyl-N-[(2S)-2-methylbutyl]-1H-indole-2-carboxamide
CID 124674116
(E)-2-[(4,6-dimethyl-1H-indole-2-carbonyl)amino]hex-4-enoic acid
CID 120692866
5-methoxy-N-[(2S)-1-methoxypropan-2-yl]-1H-indole-2-carboxamide
CID 6926471
N-[(2-hydroxycyclopentyl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide
CID 111464297
(2S)-2-[[2-[(4,6-dimethyl-1H-indole-2-carbonyl)amino]acetyl]amino]-4-methylpentanoic acid
CID 120694707
ethyl 5-[[(2R)-1-methoxypropan-2-yl]carbamoyl]-1H-indole-2-carboxylate
CID 35439173
N-[3-(2-hydroxyethoxy)propyl]-4,6-dimethyl-1H-indole-2-carboxamide
CID 110022441
N-[(2R)-1-methoxypropan-2-yl]-3,4-dimethylbenzamide
CID 5390617
N-(4-fluorophenyl)-4,6-dimethyl-1H-indole-2-carboxamide
CID 46669157
N'-[2-(4-ethoxyphenoxy)propanoyl]-4,6-dimethyl-1H-indole-2-carbohydrazide
CID 46663449

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide?
The IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide (CID 6934364) is N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide?
The canonical SMILES for N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide is COC[C@H](C)NC(=O)c1cc2c(C)cc(C)cc2[nH]1.
What is the InChIKey of N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide?
The InChIKey is RFCKCNDROWSTTF-NSHDSACASA-N. The full InChI is InChI=1S/C15H20N2O2/c1-9-5-10(2)12-7-14(17-13(12)6-9)15(18)16-11(3)8-19-4/h5-7,11,17H,8H2,1-4H3,(H,16,18)/t11-/m0/s1.
What are the key properties of N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide?
N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-methoxypropan-2-yl]-4,6-dimethyl-1H-indole-2-carboxamide is sourced from PubChem (CID 6934364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).