N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide

C17H24N2O2 — CID 107127273

IUPACN-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
SMILESCCOC1CC(N)C1NC(=O)C1CCc2ccccc2C1
InChIInChI=1S/C17H24N2O2/c1-2-21-15-10-14(18)16(15)19-17(20)13-8-7-11-5-3-4-6-12(11)9-13/h3-6,13-16H,2,7-10,18H2,1H3,(H,19,20)
InChIKeyJHFAUNZGFPTWPV-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.41
Rot. Bonds4

About N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide

N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide (PubChem CID 107127273) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
PubChem CID107127273
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
SMILESCCOC1CC(N)C1NC(=O)C1CCc2ccccc2C1
InChIInChI=1S/C17H24N2O2/c1-2-21-15-10-14(18)16(15)19-17(20)13-8-7-11-5-3-4-6-12(11)9-13/h3-6,13-16H,2,7-10,18H2,1H3,(H,19,20)
InChIKeyJHFAUNZGFPTWPV-UHFFFAOYSA-N
XLogP1.41
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide (CID 107127273) is N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide is CCOC1CC(N)C1NC(=O)C1CCc2ccccc2C1.
What is the InChIKey of N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The InChIKey is JHFAUNZGFPTWPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-2-21-15-10-14(18)16(15)19-17(20)13-8-7-11-5-3-4-6-12(11)9-13/h3-6,13-16H,2,7-10,18H2,1H3,(H,19,20).
What are the key properties of N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-ethoxycyclobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 107127273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).