[(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine

C13H13N — CID 92976167

IUPAC[(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine
SMILESNC[C@@H]1Cc2cccc3cccc1c23
InChIInChI=1S/C13H13N/c14-8-11-7-10-5-1-3-9-4-2-6-12(11)13(9)10/h1-6,11H,7-8,14H2/t11-/m0/s1
InChIKeyNWYAZKKOCBVCIC-NSHDSACASA-N
MW183.25 g/mol
LogP2.44
Rot. Bonds1

About [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine

[(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine (PubChem CID 92976167) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine.

Molecular Properties

Compound Name[(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine
PubChem CID92976167
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC Name[(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine
SMILESNC[C@@H]1Cc2cccc3cccc1c23
InChIInChI=1S/C13H13N/c14-8-11-7-10-5-1-3-9-4-2-6-12(11)13(9)10/h1-6,11H,7-8,14H2/t11-/m0/s1
InChIKeyNWYAZKKOCBVCIC-NSHDSACASA-N
XLogP2.44
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1,2-dihydroacenaphthylen-1-amine;hydrochloride
CID 67331166
4-(4-iodobutyl)-4,5-dihydropyrene
CID 12847577
11-azatetracyclo[7.4.1.05,14.010,12]tetradeca-1,3,5(14),6,8-pentaene
CID 57063162
(1S)-1-hydroperoxy-1,2-dihydroacenaphthylene
CID 129383948
11-oxatetracyclo[7.4.1.05,14.010,12]tetradeca-1,3,5(14),6,8-pentaene;pyrene
CID 87844442
(5-bromo-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl)methanamine
CID 105465700
2-(1,2-dihydroacenaphthylen-1-yloxy)ethyl-triethylazanium
CID 4245314
2-[(5S)-5-(aminomethyl)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]ethanol
CID 125496402
[(5S)-5,6-dihydro-[1]benzoxepino[2,3-b]pyridin-5-yl]methanamine
CID 167169305
[(1S)-1,2-dihydroacenaphthylen-1-yl] acetate
CID 7018923
1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene
CID 174425493
7-phenyl-7,12-dihydropleiadene
CID 615155

Frequently Asked Questions

What is the IUPAC name of [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine?
The IUPAC name of [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine (CID 92976167) is [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine.
What is the SMILES notation for [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine?
The canonical SMILES for [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine is NC[C@@H]1Cc2cccc3cccc1c23.
What is the InChIKey of [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine?
The InChIKey is NWYAZKKOCBVCIC-NSHDSACASA-N. The full InChI is InChI=1S/C13H13N/c14-8-11-7-10-5-1-3-9-4-2-6-12(11)13(9)10/h1-6,11H,7-8,14H2/t11-/m0/s1.
What are the key properties of [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine?
[(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine has a molecular weight of 183.25 g/mol, XLogP of 2.44, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1,2-dihydroacenaphthylen-1-yl]methanamine is sourced from PubChem (CID 92976167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).