N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide

C15H18N2O — CID 10824090

IUPACN-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide
SMILESCCC(=O)NC1CCCc2[nH]c3ccccc3c21
InChIInChI=1S/C15H18N2O/c1-2-14(18)17-13-9-5-8-12-15(13)10-6-3-4-7-11(10)16-12/h3-4,6-7,13,16H,2,5,8-9H2,1H3,(H,17,18)
InChIKeyLMGYVWKSOWMVDX-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.07
Rot. Bonds2

About N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide

N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide (PubChem CID 10824090) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide
PubChem CID10824090
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide
SMILESCCC(=O)NC1CCCc2[nH]c3ccccc3c21
InChIInChI=1S/C15H18N2O/c1-2-14(18)17-13-9-5-8-12-15(13)10-6-3-4-7-11(10)16-12/h3-4,6-7,13,16H,2,5,8-9H2,1H3,(H,17,18)
InChIKeyLMGYVWKSOWMVDX-UHFFFAOYSA-N
XLogP3.07
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

N-methyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine
CID 65333308
(4R)-4-methyl-2,3,4,9-tetrahydro-1H-carbazole
CID 9350450
N-ethylsulfanyl-1-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)methanamine
CID 3056093
2-methoxy-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetamide
CID 124604925
(3R,4R)-4-methyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid
CID 838888
N-[(1S)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]cyclopropanecarboxamide
CID 124879022
2,2,2-trifluoro-N-(6-methoxy-2,3,4,9-tetrahydro-1H-carbazol-4-yl)acetamide
CID 10519156
1-ethyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carboxylic acid
CID 130233348
2-(3,4-dimethoxyphenyl)-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetamide
CID 97496764
ethyl 5-hydroxy-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate
CID 23765459
2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 17415768
N-[(8R)-5,6,7,8-tetrahydroquinolin-8-yl]propanamide
CID 165447452

Frequently Asked Questions

What is the IUPAC name of N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide?
The IUPAC name of N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide (CID 10824090) is N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide.
What is the SMILES notation for N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide?
The canonical SMILES for N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide is CCC(=O)NC1CCCc2[nH]c3ccccc3c21.
What is the InChIKey of N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide?
The InChIKey is LMGYVWKSOWMVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-2-14(18)17-13-9-5-8-12-15(13)10-6-3-4-7-11(10)16-12/h3-4,6-7,13,16H,2,5,8-9H2,1H3,(H,17,18).
What are the key properties of N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide?
N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide has a molecular weight of 242.32 g/mol, XLogP of 3.07, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)propanamide is sourced from PubChem (CID 10824090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).