N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

C20H30N2O — CID 112799932

IUPACN-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESCC1CCCCC1NCC(=O)N(C)C1CCCc2ccccc21
InChIInChI=1S/C20H30N2O/c1-15-8-3-6-12-18(15)21-14-20(23)22(2)19-13-7-10-16-9-4-5-11-17(16)19/h4-5,9,11,15,18-19,21H,3,6-8,10,12-14H2,1-2H3
InChIKeyQJJVBUAPWRELHE-UHFFFAOYSA-N
MW314.47 g/mol
LogP3.69
Rot. Bonds4

About N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (PubChem CID 112799932) has the molecular formula C20H30N2O and a molecular weight of 314.47 g/mol. Its IUPAC name is N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
PubChem CID112799932
Molecular FormulaC20H30N2O
Molecular Weight314.47 g/mol
Exact Mass314.24
IUPAC NameN-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESCC1CCCCC1NCC(=O)N(C)C1CCCc2ccccc21
InChIInChI=1S/C20H30N2O/c1-15-8-3-6-12-18(15)21-14-20(23)22(2)19-13-7-10-16-9-4-5-11-17(16)19/h4-5,9,11,15,18-19,21H,3,6-8,10,12-14H2,1-2H3
InChIKeyQJJVBUAPWRELHE-UHFFFAOYSA-N
XLogP3.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.47
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(tert-butylamino)-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 112724240
3-(ethylamino)-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 3064453
2-(2-methoxyethoxy)-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 103601646
N-cyclopropyl-2-[methyl-[2-[methyl-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-2-oxoethyl]amino]acetamide
CID 8910380
4-hydroxy-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide
CID 79200379
3-methyl-5-[methyl(1,2,3,4-tetrahydronaphthalen-1-yl)amino]-5-oxopentanoic acid
CID 62966289
N-(4-fluorophenyl)-2-[methyl-[2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-2-oxoethyl]amino]acetamide
CID 9348216
N-(4-fluorophenyl)-2-[methyl-[2-[methyl-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-2-oxoethyl]amino]acetamide
CID 9348212
2-fluoro-5-[[2-[methyl(1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-oxoethyl]amino]benzamide
CID 51124467
N-(2,6-dimethylphenyl)-2-[methyl-[2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-2-oxoethyl]amino]acetamide
CID 9347975
(2S)-2-amino-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 54980190
2-[methyl-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]acetic acid
CID 118026509

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The IUPAC name of N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (CID 112799932) is N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.
What is the SMILES notation for N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The canonical SMILES for N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is CC1CCCCC1NCC(=O)N(C)C1CCCc2ccccc21.
What is the InChIKey of N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The InChIKey is QJJVBUAPWRELHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O/c1-15-8-3-6-12-18(15)21-14-20(23)22(2)19-13-7-10-16-9-4-5-11-17(16)19/h4-5,9,11,15,18-19,21H,3,6-8,10,12-14H2,1-2H3.
What are the key properties of N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide has a molecular weight of 314.47 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(2-methylcyclohexyl)amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 112799932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).