N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide

C13H17N3O — CID 10728235

IUPACN-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide
SMILESCN(C)CCNC(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C13H17N3O/c1-16(2)8-7-14-13(17)12-9-10-5-3-4-6-11(10)15-12/h3-6,9,15H,7-8H2,1-2H3,(H,14,17)
InChIKeyZXPZLZYAXQVLSK-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.46
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide

N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide (PubChem CID 10728235) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide
PubChem CID10728235
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC NameN-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide
SMILESCN(C)CCNC(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C13H17N3O/c1-16(2)8-7-14-13(17)12-9-10-5-3-4-6-11(10)15-12/h3-6,9,15H,7-8H2,1-2H3,(H,14,17)
InChIKeyZXPZLZYAXQVLSK-UHFFFAOYSA-N
XLogP1.46
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide (CID 10728235) is N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide is CN(C)CCNC(=O)c1cc2ccccc2[nH]1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide?
The InChIKey is ZXPZLZYAXQVLSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-16(2)8-7-14-13(17)12-9-10-5-3-4-6-11(10)15-12/h3-6,9,15H,7-8H2,1-2H3,(H,14,17).
What are the key properties of N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide?
N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide has a molecular weight of 231.30 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 10728235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).