[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine

C15H19N3 — CID 63771609

IUPAC[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine
SMILESNCc1nccn1CC1CCCc2ccccc21
InChIInChI=1S/C15H19N3/c16-10-15-17-8-9-18(15)11-13-6-3-5-12-4-1-2-7-14(12)13/h1-2,4,7-9,13H,3,5-6,10-11,16H2
InChIKeyPUIWASHDOUWCNW-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.46
Rot. Bonds3

About [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine

[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine (PubChem CID 63771609) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine.

Molecular Properties

Compound Name[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine
PubChem CID63771609
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine
SMILESNCc1nccn1CC1CCCc2ccccc21
InChIInChI=1S/C15H19N3/c16-10-15-17-8-9-18(15)11-13-6-3-5-12-4-1-2-7-14(12)13/h1-2,4,7-9,13H,3,5-6,10-11,16H2
InChIKeyPUIWASHDOUWCNW-UHFFFAOYSA-N
XLogP2.46
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine?
The IUPAC name of [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine (CID 63771609) is [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine.
What is the SMILES notation for [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine?
The canonical SMILES for [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine is NCc1nccn1CC1CCCc2ccccc21.
What is the InChIKey of [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine?
The InChIKey is PUIWASHDOUWCNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c16-10-15-17-8-9-18(15)11-13-6-3-5-12-4-1-2-7-14(12)13/h1-2,4,7-9,13H,3,5-6,10-11,16H2.
What are the key properties of [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine?
[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine has a molecular weight of 241.34 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-2-yl]methanamine is sourced from PubChem (CID 63771609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).