4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile

C19H15N5 — CID 10757559

IUPAC4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile
SMILESCCn1c2ccccc2c2cc(C3CN=NC3(C#N)C#N)ccc21
InChIInChI=1S/C19H15N5/c1-2-24-17-6-4-3-5-14(17)15-9-13(7-8-18(15)24)16-10-22-23-19(16,11-20)12-21/h3-9,16H,2,10H2,1H3
InChIKeyWGCFVAIRTLQYSA-UHFFFAOYSA-N
MW313.36 g/mol
LogP4.15
Rot. Bonds2

About 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile

4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile (PubChem CID 10757559) has the molecular formula C19H15N5 and a molecular weight of 313.36 g/mol. Its IUPAC name is 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile.

Molecular Properties

Compound Name4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile
PubChem CID10757559
Molecular FormulaC19H15N5
Molecular Weight313.36 g/mol
Exact Mass313.13
IUPAC Name4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile
SMILESCCn1c2ccccc2c2cc(C3CN=NC3(C#N)C#N)ccc21
InChIInChI=1S/C19H15N5/c1-2-24-17-6-4-3-5-14(17)15-9-13(7-8-18(15)24)16-10-22-23-19(16,11-20)12-21/h3-9,16H,2,10H2,1H3
InChIKeyWGCFVAIRTLQYSA-UHFFFAOYSA-N
XLogP4.15
TPSA77.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-4-(9-ethylcarbazol-3-yl)-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile
CID 3336426
9-ethyl-3-pyrrolidin-3-ylcarbazole
CID 117415894
(3S)-3-(9-ethylcarbazol-3-yl)morpholine
CID 171193383
2,3,5,6-tetrakis(9-ethylcarbazol-3-yl)benzene-1,4-dicarbonitrile
CID 118404976
(9-ethylcarbazol-3-yl)-trimethylstannane
CID 71421811
4-(9-ethylcarbazol-3-yl)-2-imino-1,4,4a,5,6,7-hexahydronaphthalene-1,3,3-tricarbonitrile
CID 73130254
(3S)-3-amino-3-(9-ethylcarbazol-3-yl)propanenitrile
CID 171260153
9-ethyl-3-[(4S)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl]carbazole
CID 95141152
(4S)-4-(9-ethylcarbazol-3-yl)-1,3-oxazolidin-2-one
CID 171184159
2,5-bis(9-ethylcarbazol-3-yl)benzene-1,4-dicarbonitrile
CID 139204592
N-(9-ethylcarbazol-3-yl)methanimine
CID 163885182
N-[(9-ethylcarbazol-3-yl)methyl]cyclopentanamine;hydrochloride
CID 17331028

Frequently Asked Questions

What is the IUPAC name of 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile?
The IUPAC name of 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile (CID 10757559) is 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile.
What is the SMILES notation for 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile?
The canonical SMILES for 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile is CCn1c2ccccc2c2cc(C3CN=NC3(C#N)C#N)ccc21.
What is the InChIKey of 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile?
The InChIKey is WGCFVAIRTLQYSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5/c1-2-24-17-6-4-3-5-14(17)15-9-13(7-8-18(15)24)16-10-22-23-19(16,11-20)12-21/h3-9,16H,2,10H2,1H3.
What are the key properties of 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile?
4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile has a molecular weight of 313.36 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9-ethylcarbazol-3-yl)-3,4-dihydropyrazole-5,5-dicarbonitrile is sourced from PubChem (CID 10757559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).