N-[carbazol-9-yl(methylamino)methyl]hydroxylamine

C14H15N3O — CID 167289851

IUPACN-[carbazol-9-yl(methylamino)methyl]hydroxylamine
SMILESCNC(NO)n1c2ccccc2c2ccccc21
InChIInChI=1S/C14H15N3O/c1-15-14(16-18)17-12-8-4-2-6-10(12)11-7-3-5-9-13(11)17/h2-9,14-16,18H,1H3
InChIKeyBUWZSPCGPGRXBQ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.45
Rot. Bonds3

About N-[carbazol-9-yl(methylamino)methyl]hydroxylamine

N-[carbazol-9-yl(methylamino)methyl]hydroxylamine (PubChem CID 167289851) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-[carbazol-9-yl(methylamino)methyl]hydroxylamine.

Molecular Properties

Compound NameN-[carbazol-9-yl(methylamino)methyl]hydroxylamine
PubChem CID167289851
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-[carbazol-9-yl(methylamino)methyl]hydroxylamine
SMILESCNC(NO)n1c2ccccc2c2ccccc21
InChIInChI=1S/C14H15N3O/c1-15-14(16-18)17-12-8-4-2-6-10(12)11-7-3-5-9-13(11)17/h2-9,14-16,18H,1H3
InChIKeyBUWZSPCGPGRXBQ-UHFFFAOYSA-N
XLogP2.45
TPSA49.22 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[carbazol-9-yl(methylamino)methyl]hydroxylamine?
The IUPAC name of N-[carbazol-9-yl(methylamino)methyl]hydroxylamine (CID 167289851) is N-[carbazol-9-yl(methylamino)methyl]hydroxylamine.
What is the SMILES notation for N-[carbazol-9-yl(methylamino)methyl]hydroxylamine?
The canonical SMILES for N-[carbazol-9-yl(methylamino)methyl]hydroxylamine is CNC(NO)n1c2ccccc2c2ccccc21.
What is the InChIKey of N-[carbazol-9-yl(methylamino)methyl]hydroxylamine?
The InChIKey is BUWZSPCGPGRXBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-15-14(16-18)17-12-8-4-2-6-10(12)11-7-3-5-9-13(11)17/h2-9,14-16,18H,1H3.
What are the key properties of N-[carbazol-9-yl(methylamino)methyl]hydroxylamine?
N-[carbazol-9-yl(methylamino)methyl]hydroxylamine has a molecular weight of 241.29 g/mol, XLogP of 2.45, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[carbazol-9-yl(methylamino)methyl]hydroxylamine is sourced from PubChem (CID 167289851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).