(8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide

C19H19N5O — CID 135465352

IUPAC(8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide
SMILESCN/N=C1\CCCc2c1[nH]c1ccc(C(=O)Nc3cccnc3)cc21
InChIInChI=1S/C19H19N5O/c1-20-24-17-6-2-5-14-15-10-12(7-8-16(15)23-18(14)17)19(25)22-13-4-3-9-21-11-13/h3-4,7-11,20,23H,2,5-6H2,1H3,(H,22,25)/b24-17+
InChIKeyNCWVIKRFTNHLRO-JJIBRWJFSA-N
MW333.40 g/mol
LogP3.08
Rot. Bonds3

About (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide

(8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide (PubChem CID 135465352) has the molecular formula C19H19N5O and a molecular weight of 333.40 g/mol. Its IUPAC name is (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide.

Molecular Properties

Compound Name(8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide
PubChem CID135465352
Molecular FormulaC19H19N5O
Molecular Weight333.40 g/mol
Exact Mass333.16
IUPAC Name(8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide
SMILESCN/N=C1\CCCc2c1[nH]c1ccc(C(=O)Nc3cccnc3)cc21
InChIInChI=1S/C19H19N5O/c1-20-24-17-6-2-5-14-15-10-12(7-8-16(15)23-18(14)17)19(25)22-13-4-3-9-21-11-13/h3-4,7-11,20,23H,2,5-6H2,1H3,(H,22,25)/b24-17+
InChIKeyNCWVIKRFTNHLRO-JJIBRWJFSA-N
XLogP3.08
TPSA82.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.40
LogP ≤ 53.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

9-oxo-N-pyridin-3-yl-10H-acridine-2-carboxamide
CID 75511238
(5E)-1-oxo-N-pyridin-3-yl-5-(pyridin-2-ylhydrazinylidene)-2,3,4,10-tetrahydroazepino[3,4-b]indole-7-carboxamide
CID 135873830
1,5-dioxo-N-pyridin-3-yl-2,3,4,10-tetrahydroazepino[3,4-b]indole-7-carboxamide;N-(methylideneamino)pyridin-2-amine;1-oxo-N-pyridin-3-yl-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indole-7-carboxamide;pyridin-2-ylhydrazine
CID 159389333
4-hydrazinyl-3-methyl-N-pyridin-3-ylbenzamide
CID 63212144
1,3-dimethyl-N-pyridin-3-ylindole-5-carboxamide
CID 145363454
N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142430
N-[(E)-2,3,4,9-tetrahydrocarbazol-1-ylideneamino]pyridine-4-carboxamide
CID 135625915
1-N,3-N-dipyridin-3-ylbenzene-1,3-dicarboxamide
CID 679756
3,5-dimethyl-N-pyridin-3-yl-1H-indole-2-carboxamide
CID 84579294
ethane;3-methyl-N-pyridin-3-ylbenzamide
CID 145409327
N-(3-acetamidophenyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 27258967
2-methyl-1,3-dioxo-N-pyridin-3-ylisoindole-5-carboxamide
CID 973223

Frequently Asked Questions

What is the IUPAC name of (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide?
The IUPAC name of (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide (CID 135465352) is (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide.
What is the SMILES notation for (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide?
The canonical SMILES for (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide is CN/N=C1\CCCc2c1[nH]c1ccc(C(=O)Nc3cccnc3)cc21.
What is the InChIKey of (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide?
The InChIKey is NCWVIKRFTNHLRO-JJIBRWJFSA-N. The full InChI is InChI=1S/C19H19N5O/c1-20-24-17-6-2-5-14-15-10-12(7-8-16(15)23-18(14)17)19(25)22-13-4-3-9-21-11-13/h3-4,7-11,20,23H,2,5-6H2,1H3,(H,22,25)/b24-17+.
What are the key properties of (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide?
(8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide has a molecular weight of 333.40 g/mol, XLogP of 3.08, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8E)-8-(methylhydrazinylidene)-N-pyridin-3-yl-5,6,7,9-tetrahydrocarbazole-3-carboxamide is sourced from PubChem (CID 135465352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).