4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide

C19H16N4O — CID 163961867

IUPAC4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide
SMILESNc1ccc(C(=O)Nc2ccc3c(c2)[nH]c2cc(N)ccc23)cc1
InChIInChI=1S/C19H16N4O/c20-12-3-1-11(2-4-12)19(24)22-14-6-8-16-15-7-5-13(21)9-17(15)23-18(16)10-14/h1-10,23H,20-21H2,(H,22,24)
InChIKeySIEWBLMMBKZZCZ-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.74
Rot. Bonds2

About 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide

4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide (PubChem CID 163961867) has the molecular formula C19H16N4O and a molecular weight of 316.36 g/mol. Its IUPAC name is 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide.

Molecular Properties

Compound Name4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide
PubChem CID163961867
Molecular FormulaC19H16N4O
Molecular Weight316.36 g/mol
Exact Mass316.13
IUPAC Name4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide
SMILESNc1ccc(C(=O)Nc2ccc3c(c2)[nH]c2cc(N)ccc23)cc1
InChIInChI=1S/C19H16N4O/c20-12-3-1-11(2-4-12)19(24)22-14-6-8-16-15-7-5-13(21)9-17(15)23-18(16)10-14/h1-10,23H,20-21H2,(H,22,24)
InChIKeySIEWBLMMBKZZCZ-UHFFFAOYSA-N
XLogP3.74
TPSA96.93 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.74
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 121331562
4-amino-N-(4-aminophenyl)benzamide;ethanamine
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CID 150367219
4-amino-N-[4-[[4-[(4-aminobenzoyl)amino]phenyl]diazenyl]phenyl]benzamide
CID 134597340
N-(9H-carbazol-3-yl)-4-phenylbenzamide
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CID 90103909
4-tert-butyl-N-(9H-carbazol-3-yl)benzamide
CID 43917219
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CID 43696909
4-amino-N-(3-hydroxy-4-methoxyphenyl)benzamide
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1-N,4-N-bis[4-[4-amino-2-(trifluoromethyl)phenyl]-3-(trifluoromethyl)phenyl]benzene-1,4-dicarboxamide
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4-amino-N-[2-[4-(ethylcarbamoylamino)phenyl]-3H-benzimidazol-5-yl]benzamide;dihydrochloride
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CID 1160309

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide?
The IUPAC name of 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide (CID 163961867) is 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide.
What is the SMILES notation for 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide?
The canonical SMILES for 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide is Nc1ccc(C(=O)Nc2ccc3c(c2)[nH]c2cc(N)ccc23)cc1.
What is the InChIKey of 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide?
The InChIKey is SIEWBLMMBKZZCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O/c20-12-3-1-11(2-4-12)19(24)22-14-6-8-16-15-7-5-13(21)9-17(15)23-18(16)10-14/h1-10,23H,20-21H2,(H,22,24).
What are the key properties of 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide?
4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide has a molecular weight of 316.36 g/mol, XLogP of 3.74, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(7-amino-9H-carbazol-2-yl)benzamide is sourced from PubChem (CID 163961867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).