[(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine

C12H17N — CID 94565802

IUPAC[(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine
SMILESC[C@@]1(CN)CCCc2ccccc21
InChIInChI=1S/C12H17N/c1-12(9-13)8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7H,4,6,8-9,13H2,1H3/t12-/m0/s1
InChIKeySUIXJECFFZGKML-LBPRGKRZSA-N
MW175.28 g/mol
LogP2.24
Rot. Bonds1

About [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine

[(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine (PubChem CID 94565802) has the molecular formula C12H17N and a molecular weight of 175.28 g/mol. Its IUPAC name is [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine.

Molecular Properties

Compound Name[(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine
PubChem CID94565802
Molecular FormulaC12H17N
Molecular Weight175.28 g/mol
Exact Mass175.14
IUPAC Name[(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine
SMILESC[C@@]1(CN)CCCc2ccccc21
InChIInChI=1S/C12H17N/c1-12(9-13)8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7H,4,6,8-9,13H2,1H3/t12-/m0/s1
InChIKeySUIXJECFFZGKML-LBPRGKRZSA-N
XLogP2.24
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(7-methyl-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methanamine;hydrochloride
CID 167717873
1-(aminomethyl)-3,4-dihydro-2H-naphthalen-1-ol
CID 12914859
(8-bromo-1-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanamine
CID 84729237
(1-cyclopropyl-3,4-dihydro-2H-naphthalen-1-yl)methanamine
CID 104819342
1-(aminomethyl)-N-methyl-N-(2-methylpropyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 43271968
4,4-diethyl-2,3-dihydro-1H-naphthalene
CID 520431
3-methyl-3-propyl-1,2-dihydroindene
CID 145156021
(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methanamine
CID 82933231
cis-(1R,3S)-1-amino-3-hydroxy-2,2-dimethyl-N-[(1-methyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]cyclobutane-1-carboxamide
CID 166355058
[1-(2-methylbutyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 63521983
1-(aminomethyl)-N-ethyl-N-propan-2-yl-3,4-dihydro-2H-naphthalen-1-amine
CID 43265604
2-[1-(aminomethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3-methylbutan-2-ol
CID 79127744

Frequently Asked Questions

What is the IUPAC name of [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine?
The IUPAC name of [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine (CID 94565802) is [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine.
What is the SMILES notation for [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine?
The canonical SMILES for [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine is C[C@@]1(CN)CCCc2ccccc21.
What is the InChIKey of [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine?
The InChIKey is SUIXJECFFZGKML-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H17N/c1-12(9-13)8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7H,4,6,8-9,13H2,1H3/t12-/m0/s1.
What are the key properties of [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine?
[(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine has a molecular weight of 175.28 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine is sourced from PubChem (CID 94565802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).