2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine

C20H19N3O — CID 173239314

IUPAC2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine
SMILESNc1ccccc1NCCOc1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C20H19N3O/c21-17-6-2-4-8-19(17)22-11-12-24-14-9-10-16-15-5-1-3-7-18(15)23-20(16)13-14/h1-10,13,22-23H,11-12,21H2
InChIKeyPLYNSLRRNKOUDN-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.39
Rot. Bonds5

About 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine

2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine (PubChem CID 173239314) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine.

Molecular Properties

Compound Name2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine
PubChem CID173239314
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC Name2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine
SMILESNc1ccccc1NCCOc1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C20H19N3O/c21-17-6-2-4-8-19(17)22-11-12-24-14-9-10-16-15-5-1-3-7-18(15)23-20(16)13-14/h1-10,13,22-23H,11-12,21H2
InChIKeyPLYNSLRRNKOUDN-UHFFFAOYSA-N
XLogP4.39
TPSA63.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-bromo-N-[2-[2-(9H-carbazol-2-yloxy)ethylamino]phenyl]methanesulfonamide
CID 141028549
2-N-(2-phenoxyethyl)benzene-1,2-diamine
CID 2295787
N-ethyl-2-[[7-[2-(ethylamino)ethoxy]-9H-carbazol-2-yl]oxy]ethanamine
CID 57439411
2-[2-(9H-carbazol-2-yloxy)ethylamino]-2-(2-fluorophenyl)ethanol
CID 70187861
2-(cyclopropylmethoxy)-9H-carbazole
CID 143672103
2-(9H-carbazol-2-yloxy)-N-(2-methylphenyl)acetamide
CID 17493998
N-benzyl-2-[(6-methoxy-9H-carbazol-2-yl)oxy]ethanamine
CID 10132371
[2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride
CID 18615090
N-butyl-2-(9H-carbazol-2-yloxy)acetamide
CID 7714244
2-(9H-carbazol-2-yloxy)-N-phenylacetamide
CID 7714190
2-(9H-pyrido[2,3-b]indol-7-yloxy)ethanamine
CID 67086167
3-[2-(diethylamino)ethoxy]-10H-acridin-9-one
CID 24991441

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine?
The IUPAC name of 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine (CID 173239314) is 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine.
What is the SMILES notation for 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine?
The canonical SMILES for 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine is Nc1ccccc1NCCOc1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine?
The InChIKey is PLYNSLRRNKOUDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c21-17-6-2-4-8-19(17)22-11-12-24-14-9-10-16-15-5-1-3-7-18(15)23-20(16)13-14/h1-10,13,22-23H,11-12,21H2.
What are the key properties of 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine?
2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine has a molecular weight of 317.39 g/mol, XLogP of 4.39, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-(9H-carbazol-2-yloxy)ethyl]benzene-1,2-diamine is sourced from PubChem (CID 173239314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).