N-(1H-indol-2-ylmethyl)formamide

C10H10N2O — CID 54534530

IUPACN-(1H-indol-2-ylmethyl)formamide
SMILESO=CNCc1cc2ccccc2[nH]1
InChIInChI=1S/C10H10N2O/c13-7-11-6-9-5-8-3-1-2-4-10(8)12-9/h1-5,7,12H,6H2,(H,11,13)
InChIKeyDTBDZDXHJOAQNV-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.41
Rot. Bonds3

About N-(1H-indol-2-ylmethyl)formamide

N-(1H-indol-2-ylmethyl)formamide (PubChem CID 54534530) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is N-(1H-indol-2-ylmethyl)formamide.

Molecular Properties

Compound NameN-(1H-indol-2-ylmethyl)formamide
PubChem CID54534530
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC NameN-(1H-indol-2-ylmethyl)formamide
SMILESO=CNCc1cc2ccccc2[nH]1
InChIInChI=1S/C10H10N2O/c13-7-11-6-9-5-8-3-1-2-4-10(8)12-9/h1-5,7,12H,6H2,(H,11,13)
InChIKeyDTBDZDXHJOAQNV-UHFFFAOYSA-N
XLogP1.41
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

1H-indol-2-ylmethylcarbamic acid
CID 68691362
2,2,2-trifluoro-N-(1H-indol-2-ylmethyl)ethanamine
CID 62095860
N-(1H-indol-2-ylmethyl)acetamide
CID 66552376
1-[3-[3,5-bis[(1H-indol-2-ylmethylamino)methyl]phenyl]-5-[(1H-indol-2-ylmethylamino)methyl]phenyl]-N-(1H-indol-2-ylmethyl)methanamine
CID 150046479
(2S)-3-(1H-indol-2-yl)-2-(methylamino)propanal
CID 135189875
N-[[3,5-bis[(1H-indol-2-ylmethylamino)methyl]-2,4,6-trimethoxyphenyl]methyl]-1-(1H-indol-2-yl)methanamine
CID 72697712
N-(1H-indol-2-ylmethyl)-2-methylbutan-1-amine
CID 115763447
2-ethylsulfonyl-N-(1H-indol-2-ylmethyl)aniline
CID 91662200
2-(2-fluoroethyl)-1H-indole
CID 142633825
3-(1H-indol-2-yl)prop-1-en-1-ol
CID 67309346
1H-indol-2-ylmethanesulfonamide
CID 54351083
2-hydroxy-N-(1H-indol-2-ylmethyl)-4-methylpentanamide
CID 86286685

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-2-ylmethyl)formamide?
The IUPAC name of N-(1H-indol-2-ylmethyl)formamide (CID 54534530) is N-(1H-indol-2-ylmethyl)formamide.
What is the SMILES notation for N-(1H-indol-2-ylmethyl)formamide?
The canonical SMILES for N-(1H-indol-2-ylmethyl)formamide is O=CNCc1cc2ccccc2[nH]1.
What is the InChIKey of N-(1H-indol-2-ylmethyl)formamide?
The InChIKey is DTBDZDXHJOAQNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c13-7-11-6-9-5-8-3-1-2-4-10(8)12-9/h1-5,7,12H,6H2,(H,11,13).
What are the key properties of N-(1H-indol-2-ylmethyl)formamide?
N-(1H-indol-2-ylmethyl)formamide has a molecular weight of 174.20 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-2-ylmethyl)formamide is sourced from PubChem (CID 54534530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).