N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide

C12H14N2O2 — CID 89488958

IUPACN-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2[nH]c(C(=O)NCCO)cc2c1
InChIInChI=1S/C12H14N2O2/c1-8-2-3-10-9(6-8)7-11(14-10)12(16)13-4-5-15/h2-3,6-7,14-15H,4-5H2,1H3,(H,13,16)
InChIKeyZFOHZJAHNWJFRZ-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.20
Rot. Bonds3

About N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide

N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide (PubChem CID 89488958) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide
PubChem CID89488958
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC NameN-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2[nH]c(C(=O)NCCO)cc2c1
InChIInChI=1S/C12H14N2O2/c1-8-2-3-10-9(6-8)7-11(14-10)12(16)13-4-5-15/h2-3,6-7,14-15H,4-5H2,1H3,(H,13,16)
InChIKeyZFOHZJAHNWJFRZ-UHFFFAOYSA-N
XLogP1.20
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(dimethylamino)propyl]-5-methyl-1H-indole-2-carboxamide
CID 113207116
N-[2-(4-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide
CID 36704078
5-methyl-N-prop-2-enyl-1H-indole-2-carboxamide
CID 4011828
N-(hydroxymethyl)-6-methyl-1H-indole-2-carboxamide
CID 177170209
N-[2-(1,2-benzothiazol-3-ylamino)ethyl]-5-methyl-1H-indole-2-carboxamide
CID 11854233
3-(5-methyl-1H-indol-2-yl)-3-oxopropanoic acid
CID 165356574
2-(methylamino)-1-(5-methyl-1H-indol-2-yl)ethanone
CID 82397100
5-methyl-N-phenyl-1H-indole-2-carboxamide
CID 3254922
(5-methyl-1H-indol-2-yl)-(4-methylphenyl)methanone
CID 59088766
N-cyclohexyl-5-methyl-1H-indole-2-carboxamide
CID 3886919
N-[2-[3-[4-(aminomethyl)phenyl]propyl-methylamino]ethyl]-5-methyl-1H-indole-2-carboxamide
CID 10271027
N-[[4-(methanesulfonamido)phenyl]methyl]-5-methyl-1H-indole-2-carboxamide
CID 47057856

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide (CID 89488958) is N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide is Cc1ccc2[nH]c(C(=O)NCCO)cc2c1.
What is the InChIKey of N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide?
The InChIKey is ZFOHZJAHNWJFRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-8-2-3-10-9(6-8)7-11(14-10)12(16)13-4-5-15/h2-3,6-7,14-15H,4-5H2,1H3,(H,13,16).
What are the key properties of N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide?
N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 1.20, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide is sourced from PubChem (CID 89488958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).