1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide

C14H12N4O — CID 135526980

IUPAC1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide
SMILESNC(=O)c1ccc2[nH]c3c(c2c1)CCc1cn[nH]c1-3
InChIInChI=1S/C14H12N4O/c15-14(19)7-2-4-11-10(5-7)9-3-1-8-6-16-18-12(8)13(9)17-11/h2,4-6,17H,1,3H2,(H2,15,19)(H,16,18)
InChIKeyTUSSCSPELICNFH-UHFFFAOYSA-N
MW252.28 g/mol
LogP1.76
Rot. Bonds1

About 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide

1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide (PubChem CID 135526980) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide.

Molecular Properties

Compound Name1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide
PubChem CID135526980
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC Name1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide
SMILESNC(=O)c1ccc2[nH]c3c(c2c1)CCc1cn[nH]c1-3
InChIInChI=1S/C14H12N4O/c15-14(19)7-2-4-11-10(5-7)9-3-1-8-6-16-18-12(8)13(9)17-11/h2,4-6,17H,1,3H2,(H2,15,19)(H,16,18)
InChIKeyTUSSCSPELICNFH-UHFFFAOYSA-N
XLogP1.76
TPSA87.56 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxylate
CID 135412762
N-propan-2-yl-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide
CID 135516734
N-(2-anilinoethyl)-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide
CID 135465614
N-[2-(1H-imidazol-5-yl)ethyl]-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide
CID 135474390
3,4-dihydropyrazolo[5,4-b]indole-7-carboxamide
CID 166107175
N-tert-butyl-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-8-carboxamide
CID 135432895
8-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole
CID 135453861
[4-(2-fluorophenyl)-4-hydroxypiperidin-1-yl]-(3,4,17-triazatetracyclo[8.7.0.02,6.011,16]heptadeca-1(10),2(6),4,11(16),12,14-hexaen-13-yl)methanone
CID 135505818
N-[2-(1H-imidazol-5-yl)ethyl]-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-8-carboxamide
CID 135511967
4,5-dihydro-1H-benzo[g]indazole-7-carboxylic acid
CID 139432787
8-amino-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 142652454
N-propan-2-yl-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-6-carboxamide
CID 135516733

Frequently Asked Questions

What is the IUPAC name of 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide?
The IUPAC name of 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide (CID 135526980) is 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide.
What is the SMILES notation for 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide?
The canonical SMILES for 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide is NC(=O)c1ccc2[nH]c3c(c2c1)CCc1cn[nH]c1-3.
What is the InChIKey of 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide?
The InChIKey is TUSSCSPELICNFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c15-14(19)7-2-4-11-10(5-7)9-3-1-8-6-16-18-12(8)13(9)17-11/h2,4-6,17H,1,3H2,(H2,15,19)(H,16,18).
What are the key properties of 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide?
1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide has a molecular weight of 252.28 g/mol, XLogP of 1.76, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole-7-carboxamide is sourced from PubChem (CID 135526980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).