(10-aminophenanthren-9-yl)methanol

C15H13NO — CID 123159194

IUPAC(10-aminophenanthren-9-yl)methanol
SMILESNc1c(CO)c2ccccc2c2ccccc12
InChIInChI=1S/C15H13NO/c16-15-13-8-4-3-6-11(13)10-5-1-2-7-12(10)14(15)9-17/h1-8,17H,9,16H2
InChIKeyCXDFCMMOHJCZCF-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.07
Rot. Bonds1

About (10-aminophenanthren-9-yl)methanol

(10-aminophenanthren-9-yl)methanol (PubChem CID 123159194) has the molecular formula C15H13NO and a molecular weight of 223.28 g/mol. Its IUPAC name is (10-aminophenanthren-9-yl)methanol.

Molecular Properties

Compound Name(10-aminophenanthren-9-yl)methanol
PubChem CID123159194
Molecular FormulaC15H13NO
Molecular Weight223.28 g/mol
Exact Mass223.10
IUPAC Name(10-aminophenanthren-9-yl)methanol
SMILESNc1c(CO)c2ccccc2c2ccccc12
InChIInChI=1S/C15H13NO/c16-15-13-8-4-3-6-11(13)10-5-1-2-7-12(10)14(15)9-17/h1-8,17H,9,16H2
InChIKeyCXDFCMMOHJCZCF-UHFFFAOYSA-N
XLogP3.07
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-Aminochrysene-1,2-dihydrodiol
CID 107900
2-(1-Aminonaphthalen-2-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 772871
2-{1-Amino-4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]-2-naphthyl}-1,1,1,3,3,3-hexafluoro-2-propanol
CID 4395364
(3-Aminonaphthalen-2-yl)methanol
CID 10374898
(4-Aminonaphthalen-1-yl)methanol
CID 118807838
(5-Amino-2,4-dimethylphenyl)methanol
CID 54594922
1,2-Dihydro-1,2-dihydroxy-6-aminochrysene
CID 3025891
6-Nitro-7-hydroxy-7,8,9,10-tetrahydrobenzo(a)pyrene
CID 152161
3-Nitro-2-naphthalenemethanol
CID 4076989
(3-Aminonaphthalen-2-yl)-diphenylmethanol
CID 10041997
2-(b-Hydroxyethyl)naphthylamine
CID 129793314
2-(2-Aminonaphthalen-1-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 1336446

Frequently Asked Questions

What is the IUPAC name of (10-aminophenanthren-9-yl)methanol?
The IUPAC name of (10-aminophenanthren-9-yl)methanol (CID 123159194) is (10-aminophenanthren-9-yl)methanol.
What is the SMILES notation for (10-aminophenanthren-9-yl)methanol?
The canonical SMILES for (10-aminophenanthren-9-yl)methanol is Nc1c(CO)c2ccccc2c2ccccc12.
What is the InChIKey of (10-aminophenanthren-9-yl)methanol?
The InChIKey is CXDFCMMOHJCZCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c16-15-13-8-4-3-6-11(13)10-5-1-2-7-12(10)14(15)9-17/h1-8,17H,9,16H2.
What are the key properties of (10-aminophenanthren-9-yl)methanol?
(10-aminophenanthren-9-yl)methanol has a molecular weight of 223.28 g/mol, XLogP of 3.07, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (10-aminophenanthren-9-yl)methanol is sourced from PubChem (CID 123159194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).