(1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide

C32H36N2O2 — CID 155468589

IUPAC(1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide
SMILESC[C@H]1c2ccccc2CC[C@H]1C(=O)NCc1ccc(CNC(=O)[C@@H]2CCc3ccccc3[C@@H]2C)cc1
InChIInChI=1S/C32H36N2O2/c1-21-27-9-5-3-7-25(27)15-17-29(21)31(35)33-19-23-11-13-24(14-12-23)20-34-32(36)30-18-16-26-8-4-6-10-28(26)22(30)2/h3-14,21-22,29-30H,15-20H2,1-2H3,(H,33,35)(H,34,36)/t21-,22-,29+,30+/m0/s1
InChIKeyOJBBCZLDRRNTIN-PDNQGOMLSA-N
MW480.65 g/mol
LogP5.65
Rot. Bonds6

About (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide

(1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide (PubChem CID 155468589) has the molecular formula C32H36N2O2 and a molecular weight of 480.65 g/mol. Its IUPAC name is (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound Name(1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide
PubChem CID155468589
Molecular FormulaC32H36N2O2
Molecular Weight480.65 g/mol
Exact Mass480.28
IUPAC Name(1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide
SMILESC[C@H]1c2ccccc2CC[C@H]1C(=O)NCc1ccc(CNC(=O)[C@@H]2CCc3ccccc3[C@@H]2C)cc1
InChIInChI=1S/C32H36N2O2/c1-21-27-9-5-3-7-25(27)15-17-29(21)31(35)33-19-23-11-13-24(14-12-23)20-34-32(36)30-18-16-26-8-4-6-10-28(26)22(30)2/h3-14,21-22,29-30H,15-20H2,1-2H3,(H,33,35)(H,34,36)/t21-,22-,29+,30+/m0/s1
InChIKeyOJBBCZLDRRNTIN-PDNQGOMLSA-N
XLogP5.65
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500480.65
LogP ≤ 55.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-N-benzyl-2-methylcyclopropane-1-carboxamide
CID 164843692
N-[(4-bromophenyl)methyl]-2-(2,3-dihydro-1H-inden-1-yl)acetamide
CID 86955694
5-methyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene-6-carboxylic acid
CID 59125395
2-(2,3-dihydro-1H-inden-1-yl)-N-[[4-(hydroxymethyl)phenyl]methyl]acetamide
CID 77089339
N-[[4-[(2,3-dihydro-1H-indene-2-carbonylamino)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 155137344
(1R)-N-benzyl-3,4-dihydro-1H-isochromene-1-carboxamide
CID 7343697
cis-(1R,2S)-2-(benzylcarbamoyl)cyclopropane-1-carboxylic acid
CID 51776902
1-[(4-methylsulfanylphenyl)methyl]-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
CID 60580789
1-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
CID 18477073
N-[(4-hydroxyphenyl)methyl]-2-methylcyclopropane-1-carboxamide
CID 47148508
methyl 4-[(1,2,3,4-tetrahydronaphthalene-2-carbonylamino)methyl]benzoate
CID 51355167
4-[[[(1S)-3,4-dihydro-1H-isochromene-1-carbonyl]amino]methyl]benzoic acid
CID 124626878

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide (CID 155468589) is (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide is C[C@H]1c2ccccc2CC[C@H]1C(=O)NCc1ccc(CNC(=O)[C@@H]2CCc3ccccc3[C@@H]2C)cc1.
What is the InChIKey of (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The InChIKey is OJBBCZLDRRNTIN-PDNQGOMLSA-N. The full InChI is InChI=1S/C32H36N2O2/c1-21-27-9-5-3-7-25(27)15-17-29(21)31(35)33-19-23-11-13-24(14-12-23)20-34-32(36)30-18-16-26-8-4-6-10-28(26)22(30)2/h3-14,21-22,29-30H,15-20H2,1-2H3,(H,33,35)(H,34,36)/t21-,22-,29+,30+/m0/s1.
What are the key properties of (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
(1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide has a molecular weight of 480.65 g/mol, XLogP of 5.65, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-1-methyl-N-[[4-[[[(1R,2R)-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carbonyl]amino]methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 155468589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).