N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide

C14H19N3O2 — CID 110833540

IUPACN-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide
SMILESCOc1ccc2cc(C(=O)NCC(C)(C)N)[nH]c2c1
InChIInChI=1S/C14H19N3O2/c1-14(2,15)8-16-13(18)12-6-9-4-5-10(19-3)7-11(9)17-12/h4-7,17H,8,15H2,1-3H3,(H,16,18)
InChIKeyYNFIZSSQEIGDLT-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.64
Rot. Bonds4

About N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide

N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide (PubChem CID 110833540) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide
PubChem CID110833540
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide
SMILESCOc1ccc2cc(C(=O)NCC(C)(C)N)[nH]c2c1
InChIInChI=1S/C14H19N3O2/c1-14(2,15)8-16-13(18)12-6-9-4-5-10(19-3)7-11(9)17-12/h4-7,17H,8,15H2,1-3H3,(H,16,18)
InChIKeyYNFIZSSQEIGDLT-UHFFFAOYSA-N
XLogP1.64
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 ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-fluorophenyl)-2-methoxypropyl]-6-methoxy-1H-indole-2-carboxamide
CID 90599204
6-methoxy-N-(3-methoxypropyl)-1H-indole-2-carboxamide
CID 4905349
benzyl 2-[(6-methoxy-1H-indole-2-carbonyl)amino]acetate
CID 38424752
N-(2-benzamidoethyl)-6-methoxy-1H-indole-2-carboxamide
CID 134003045
N-[(6-hydroxy-1,4-dithiepan-6-yl)methyl]-6-methoxy-1H-indole-2-carboxamide
CID 154576561
N-(1-aminopropan-2-yl)-6-methoxy-1H-indole-2-carboxamide
CID 110833539
tert-butyl N-[(6-methoxy-1H-indole-2-carbonyl)amino]carbamate
CID 71885448
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-6-methoxy-1H-indole-2-carboxamide
CID 38420989
N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-6-methoxy-1H-indole-2-carboxamide
CID 55721215
N-(2-ethylphenyl)-6-methoxy-1H-indole-2-carboxamide
CID 134002747
N-[[4-(1-hydroxyethyl)phenyl]methyl]-6-methoxy-1H-indole-2-carboxamide
CID 75417280
6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide
CID 55694524

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide (CID 110833540) is N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide is COc1ccc2cc(C(=O)NCC(C)(C)N)[nH]c2c1.
What is the InChIKey of N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide?
The InChIKey is YNFIZSSQEIGDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-14(2,15)8-16-13(18)12-6-9-4-5-10(19-3)7-11(9)17-12/h4-7,17H,8,15H2,1-3H3,(H,16,18).
What are the key properties of N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide?
N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide has a molecular weight of 261.32 g/mol, XLogP of 1.64, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-6-methoxy-1H-indole-2-carboxamide is sourced from PubChem (CID 110833540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).