1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine

C20H33N — CID 63418547

IUPAC1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine
SMILESCCCCCCCCCC(N)C1CCCc2ccccc21
InChIInChI=1S/C20H33N/c1-2-3-4-5-6-7-8-16-20(21)19-15-11-13-17-12-9-10-14-18(17)19/h9-10,12,14,19-20H,2-8,11,13,15-16,21H2,1H3
InChIKeyBXSZFVQUKNRFOZ-UHFFFAOYSA-N
MW287.49 g/mol
LogP5.57
Rot. Bonds9

About 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine

1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine (PubChem CID 63418547) has the molecular formula C20H33N and a molecular weight of 287.49 g/mol. Its IUPAC name is 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine.

Molecular Properties

Compound Name1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine
PubChem CID63418547
Molecular FormulaC20H33N
Molecular Weight287.49 g/mol
Exact Mass287.26
IUPAC Name1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine
SMILESCCCCCCCCCC(N)C1CCCc2ccccc21
InChIInChI=1S/C20H33N/c1-2-3-4-5-6-7-8-16-20(21)19-15-11-13-17-12-9-10-14-18(17)19/h9-10,12,14,19-20H,2-8,11,13,15-16,21H2,1H3
InChIKeyBXSZFVQUKNRFOZ-UHFFFAOYSA-N
XLogP5.57
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.49
LogP ≤ 55.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(2,3-dihydro-1H-inden-1-yl)undecan-1-amine
CID 65403955
1-icosan-8-yl-1,2,3,4-tetrahydronaphthalene
CID 175494887
5-methoxy-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-amine
CID 112754245
1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine
CID 105007437
1-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)octan-1-amine
CID 105124704
1-(1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naphthalen-1-yl)nonan-1-amine
CID 115835676
1-(3,4-dihydro-1H-isochromen-1-yl)heptan-1-amine
CID 105125796
1-(2,3-dihydro-1-benzothiophen-3-yl)heptan-1-amine
CID 105126135
N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-amine
CID 55188345
1-(1,2,3,4-tetrahydronaphthalen-1-yl)heptan-2-ol
CID 63902035
1-(2,3-dihydro-1H-inden-1-yl)hex-5-en-1-amine
CID 65405517
2-(2,6-dichlorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 63418546

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine?
The IUPAC name of 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine (CID 63418547) is 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine.
What is the SMILES notation for 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine?
The canonical SMILES for 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine is CCCCCCCCCC(N)C1CCCc2ccccc21.
What is the InChIKey of 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine?
The InChIKey is BXSZFVQUKNRFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N/c1-2-3-4-5-6-7-8-16-20(21)19-15-11-13-17-12-9-10-14-18(17)19/h9-10,12,14,19-20H,2-8,11,13,15-16,21H2,1H3.
What are the key properties of 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine?
1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine has a molecular weight of 287.49 g/mol, XLogP of 5.57, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine is sourced from PubChem (CID 63418547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).