N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide

C14H19N3O2 — CID 110833689

IUPACN-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide
SMILESCOc1ccc2[nH]c(C)c(C(=O)NC(C)CN)c2c1
InChIInChI=1S/C14H19N3O2/c1-8(7-15)16-14(18)13-9(2)17-12-5-4-10(19-3)6-11(12)13/h4-6,8,17H,7,15H2,1-3H3,(H,16,18)
InChIKeyUOQZUWHRASTRCE-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.56
Rot. Bonds4

About N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide

N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide (PubChem CID 110833689) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide
PubChem CID110833689
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide
SMILESCOc1ccc2[nH]c(C)c(C(=O)NC(C)CN)c2c1
InChIInChI=1S/C14H19N3O2/c1-8(7-15)16-14(18)13-9(2)17-12-5-4-10(19-3)6-11(12)13/h4-6,8,17H,7,15H2,1-3H3,(H,16,18)
InChIKeyUOQZUWHRASTRCE-UHFFFAOYSA-N
XLogP1.56
TPSA80.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 5-methoxy-2-methyl-1H-indole-3-carboxylate
CID 76852322
1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
CID 604823
5-methoxy-2-methyl-1H-indole-3-carboxylate
CID 6919949
N-(1-aminopropan-2-yl)-6-methoxy-1H-indole-2-carboxamide
CID 110833539
N-(1-aminopropan-2-yl)-2-hydroxy-5-methoxybenzamide
CID 63733200
2-hydroxy-2-methoxy-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
CID 123676378
5-methoxy-N,N,2-trimethyl-1H-indole-3-carboxamide
CID 65335449
2-(5-methoxy-2-methyl-1H-indol-3-yl)-2-oxoacetyl chloride
CID 11218944
[2-(5-methoxy-2-methyl-1H-indol-3-yl)-2-oxoethyl]-dimethylazanium
CID 3714980
2-bromo-1-(5-methoxy-2-methyl-1H-indol-3-yl)-2-methylpropan-1-one
CID 69315136
3-acetyl-6-methoxy-2-methyl-1H-quinolin-4-one
CID 139937848
3-amino-6-methoxy-2-methyl-1H-quinolin-4-one
CID 91619118

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide?
The IUPAC name of N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide (CID 110833689) is N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide is COc1ccc2[nH]c(C)c(C(=O)NC(C)CN)c2c1.
What is the InChIKey of N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide?
The InChIKey is UOQZUWHRASTRCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-8(7-15)16-14(18)13-9(2)17-12-5-4-10(19-3)6-11(12)13/h4-6,8,17H,7,15H2,1-3H3,(H,16,18).
What are the key properties of N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide?
N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide has a molecular weight of 261.32 g/mol, XLogP of 1.56, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-5-methoxy-2-methyl-1H-indole-3-carboxamide is sourced from PubChem (CID 110833689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).