6-methyl-N-propylphenanthridin-8-amine

C17H18N2 — CID 102572857

IUPAC6-methyl-N-propylphenanthridin-8-amine
SMILESCCCNc1ccc2c(c1)c(C)nc1ccccc12
InChIInChI=1S/C17H18N2/c1-3-10-18-13-8-9-14-15-6-4-5-7-17(15)19-12(2)16(14)11-13/h4-9,11,18H,3,10H2,1-2H3
InChIKeyQUQJBKJNFBWIAR-UHFFFAOYSA-N
MW250.34 g/mol
LogP4.52
Rot. Bonds3

About 6-methyl-N-propylphenanthridin-8-amine

6-methyl-N-propylphenanthridin-8-amine (PubChem CID 102572857) has the molecular formula C17H18N2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 6-methyl-N-propylphenanthridin-8-amine.

Molecular Properties

Compound Name6-methyl-N-propylphenanthridin-8-amine
PubChem CID102572857
Molecular FormulaC17H18N2
Molecular Weight250.34 g/mol
Exact Mass250.15
IUPAC Name6-methyl-N-propylphenanthridin-8-amine
SMILESCCCNc1ccc2c(c1)c(C)nc1ccccc12
InChIInChI=1S/C17H18N2/c1-3-10-18-13-8-9-14-15-6-4-5-7-17(15)19-12(2)16(14)11-13/h4-9,11,18H,3,10H2,1-2H3
InChIKeyQUQJBKJNFBWIAR-UHFFFAOYSA-N
XLogP4.52
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

2-N-(3,4-dimethylphenyl)-9-N-propylacridine-2,9-diamine
CID 171793409
N-propylaniline
CID 12153
2-N-(4-fluorophenyl)-4-N-propylquinazoline-2,4-diamine
CID 91966173
ethyl (6-methylphenanthridin-8-yl) carbonate
CID 131861123
8,9-dimethoxy-6-methylphenanthridine
CID 135040288
6-tert-butyl-2,3-dimethyl-N-propylquinolin-4-amine
CID 63481112
6-(propylamino)-2,3-dihydrophthalazine-1,4-dione
CID 25220818
2-phenyl-N-propylquinazolin-4-amine
CID 10244508
6-N-propylquinazoline-2,6-diamine
CID 144986156
2-methyl-N-propyl-1,3-benzothiazol-5-amine
CID 82672114
N-propyl-2-quinolin-3-ylpyridin-4-amine
CID 102824586
4-methyl-2-propylquinazoline
CID 102028335

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-propylphenanthridin-8-amine?
The IUPAC name of 6-methyl-N-propylphenanthridin-8-amine (CID 102572857) is 6-methyl-N-propylphenanthridin-8-amine.
What is the SMILES notation for 6-methyl-N-propylphenanthridin-8-amine?
The canonical SMILES for 6-methyl-N-propylphenanthridin-8-amine is CCCNc1ccc2c(c1)c(C)nc1ccccc12.
What is the InChIKey of 6-methyl-N-propylphenanthridin-8-amine?
The InChIKey is QUQJBKJNFBWIAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2/c1-3-10-18-13-8-9-14-15-6-4-5-7-17(15)19-12(2)16(14)11-13/h4-9,11,18H,3,10H2,1-2H3.
What are the key properties of 6-methyl-N-propylphenanthridin-8-amine?
6-methyl-N-propylphenanthridin-8-amine has a molecular weight of 250.34 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-propylphenanthridin-8-amine is sourced from PubChem (CID 102572857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).