9,10-dihydrophenanthren-4-amine

C14H13N — CID 12836481

IUPAC9,10-dihydrophenanthren-4-amine
SMILESNc1cccc2c1-c1ccccc1CC2
InChIInChI=1S/C14H13N/c15-13-7-3-5-11-9-8-10-4-1-2-6-12(10)14(11)13/h1-7H,8-9,15H2
InChIKeyAKDCXPBWWNNSSD-UHFFFAOYSA-N
MW195.27 g/mol
LogP3.03
Rot. Bonds

About 9,10-dihydrophenanthren-4-amine

9,10-dihydrophenanthren-4-amine (PubChem CID 12836481) has the molecular formula C14H13N and a molecular weight of 195.27 g/mol. Its IUPAC name is 9,10-dihydrophenanthren-4-amine.

Molecular Properties

Compound Name9,10-dihydrophenanthren-4-amine
PubChem CID12836481
Molecular FormulaC14H13N
Molecular Weight195.27 g/mol
Exact Mass195.10
IUPAC Name9,10-dihydrophenanthren-4-amine
SMILESNc1cccc2c1-c1ccccc1CC2
InChIInChI=1S/C14H13N/c15-13-7-3-5-11-9-8-10-4-1-2-6-12(10)14(11)13/h1-7H,8-9,15H2
InChIKeyAKDCXPBWWNNSSD-UHFFFAOYSA-N
XLogP3.03
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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9,10-dihydrophenanthrene;methane
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CID 12568460
9H-fluoren-4-amine;1-phenyl-9H-fluorene
CID 175396170
2-(1,2-dihydroacenaphthylen-5-yl)aniline
CID 114939446
9,10-dihydrophenanthrene;ethane
CID 143759681
18-thiaheptacyclo[17.14.0.02,17.03,8.011,16.020,25.028,33]tritriaconta-1(19),2(17),3,5,7,11,13,15,20,22,24,28,30,32-tetradecaene
CID 134848386
ethane;4,5,9,10-tetrahydropyrene
CID 157285426
1-amino-5-sulfanylanthracene-9,10-dione;1,2,3,4-tetrahydronaphthalene
CID 70615473
1,2,3,4-tetramethyl-9,10-dihydrophenanthrene
CID 175462605
(Z)-2,3-dihydroinden-1-ylidenehydrazine
CID 5382905
2,3-dihydroinden-1-ylidenezirconium(2+)
CID 162023377

Frequently Asked Questions

What is the IUPAC name of 9,10-dihydrophenanthren-4-amine?
The IUPAC name of 9,10-dihydrophenanthren-4-amine (CID 12836481) is 9,10-dihydrophenanthren-4-amine.
What is the SMILES notation for 9,10-dihydrophenanthren-4-amine?
The canonical SMILES for 9,10-dihydrophenanthren-4-amine is Nc1cccc2c1-c1ccccc1CC2.
What is the InChIKey of 9,10-dihydrophenanthren-4-amine?
The InChIKey is AKDCXPBWWNNSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N/c15-13-7-3-5-11-9-8-10-4-1-2-6-12(10)14(11)13/h1-7H,8-9,15H2.
What are the key properties of 9,10-dihydrophenanthren-4-amine?
9,10-dihydrophenanthren-4-amine has a molecular weight of 195.27 g/mol, XLogP of 3.03, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dihydrophenanthren-4-amine is sourced from PubChem (CID 12836481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).