N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide

C21H19NO — CID 7688440

IUPACN-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide
SMILESO=C(N[C@@H]1CCCc2ccccc21)c1ccc2ccccc2c1
InChIInChI=1S/C21H19NO/c23-21(18-13-12-15-6-1-2-8-17(15)14-18)22-20-11-5-9-16-7-3-4-10-19(16)20/h1-4,6-8,10,12-14,20H,5,9,11H2,(H,22,23)/t20-/m1/s1
InChIKeyOQPHLFXPOFJCNI-HXUWFJFHSA-N
MW301.39 g/mol
LogP4.65
Rot. Bonds2

About N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide

N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide (PubChem CID 7688440) has the molecular formula C21H19NO and a molecular weight of 301.39 g/mol. Its IUPAC name is N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide
PubChem CID7688440
Molecular FormulaC21H19NO
Molecular Weight301.39 g/mol
Exact Mass301.15
IUPAC NameN-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide
SMILESO=C(N[C@@H]1CCCc2ccccc21)c1ccc2ccccc2c1
InChIInChI=1S/C21H19NO/c23-21(18-13-12-15-6-1-2-8-17(15)14-18)22-20-11-5-9-16-7-3-4-10-19(16)20/h1-4,6-8,10,12-14,20H,5,9,11H2,(H,22,23)/t20-/m1/s1
InChIKeyOQPHLFXPOFJCNI-HXUWFJFHSA-N
XLogP4.65
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide?
The IUPAC name of N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide (CID 7688440) is N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide?
The canonical SMILES for N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide is O=C(N[C@@H]1CCCc2ccccc21)c1ccc2ccccc2c1.
What is the InChIKey of N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide?
The InChIKey is OQPHLFXPOFJCNI-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H19NO/c23-21(18-13-12-15-6-1-2-8-17(15)14-18)22-20-11-5-9-16-7-3-4-10-19(16)20/h1-4,6-8,10,12-14,20H,5,9,11H2,(H,22,23)/t20-/m1/s1.
What are the key properties of N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide?
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 4.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide is sourced from PubChem (CID 7688440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).