(methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine

C12H16N2 — CID 144541952

IUPAC(methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
SMILESC=NC(N)c1ccc2c(c1)CCCC2
InChIInChI=1S/C12H16N2/c1-14-12(13)11-7-6-9-4-2-3-5-10(9)8-11/h6-8,12H,1-5,13H2
InChIKeyJECZZUXIFHYPTD-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.22
Rot. Bonds2

About (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine

(methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine (PubChem CID 144541952) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound Name(methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
PubChem CID144541952
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name(methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
SMILESC=NC(N)c1ccc2c(c1)CCCC2
InChIInChI=1S/C12H16N2/c1-14-12(13)11-7-6-9-4-2-3-5-10(9)8-11/h6-8,12H,1-5,13H2
InChIKeyJECZZUXIFHYPTD-UHFFFAOYSA-N
XLogP2.22
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2,3-dihydro-1H-inden-5-ylmethanediamine
CID 116939135
(4-methylphenyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43095172
1-(5,6,7,8-tetrahydronaphthalen-2-yl)propane-1,3-diamine
CID 116932733
2,3-dihydro-1H-inden-5-yl-(4-propan-2-ylphenyl)methanamine
CID 43115552
(3-bromo-4-methylphenyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 81471918
(2,5-dimethylphenyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43093702
(3,5-dichlorophenyl)-(2,3-dihydro-1H-inden-5-yl)methanamine
CID 43115602
1-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-amine
CID 43198216
2,3-dihydro-1H-inden-5-yl(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033272
(3-bromo-5-methylphenyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 104851102
ethane;methane;6-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 160891896
5-(difluoromethyl)-2,3-dihydro-1H-indene;ethene
CID 164603454

Frequently Asked Questions

What is the IUPAC name of (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The IUPAC name of (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine (CID 144541952) is (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine.
What is the SMILES notation for (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The canonical SMILES for (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine is C=NC(N)c1ccc2c(c1)CCCC2.
What is the InChIKey of (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The InChIKey is JECZZUXIFHYPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-14-12(13)11-7-6-9-4-2-3-5-10(9)8-11/h6-8,12H,1-5,13H2.
What are the key properties of (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
(methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine has a molecular weight of 188.27 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (methylideneamino)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 144541952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).