N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide

C18H28N2O — CID 81363494

IUPACN-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide
SMILESCc1ccccc1[C@@H](C)NCC(=O)NC1CCCCCC1
InChIInChI=1S/C18H28N2O/c1-14-9-7-8-12-17(14)15(2)19-13-18(21)20-16-10-5-3-4-6-11-16/h7-9,12,15-16,19H,3-6,10-11,13H2,1-2H3,(H,20,21)/t15-/m1/s1
InChIKeyHIFGCSWWICWQNH-OAHLLOKOSA-N
MW288.44 g/mol
LogP3.48
Rot. Bonds5

About N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide

N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide (PubChem CID 81363494) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide
PubChem CID81363494
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide
SMILESCc1ccccc1[C@@H](C)NCC(=O)NC1CCCCCC1
InChIInChI=1S/C18H28N2O/c1-14-9-7-8-12-17(14)15(2)19-13-18(21)20-16-10-5-3-4-6-11-16/h7-9,12,15-16,19H,3-6,10-11,13H2,1-2H3,(H,20,21)/t15-/m1/s1
InChIKeyHIFGCSWWICWQNH-OAHLLOKOSA-N
XLogP3.48
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2-chlorophenyl)ethylamino]-N-cyclohexylacetamide
CID 51171753
N-cycloheptyl-2-[1-(2-fluorophenyl)ethylamino]acetamide
CID 60673176
N-cycloheptyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 63867372
2-(cyclopentylamino)-N-[(1S)-1-(2-methylphenyl)ethyl]acetamide
CID 81380629
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-cyclopropylacetamide
CID 81378498
N-cycloheptyl-2-[[(1R)-1-(3-methylphenyl)ethyl]amino]acetamide
CID 81367500
N-(cyclohexylcarbamoyl)-2-[1-(2-fluorophenyl)ethylamino]acetamide
CID 18086112
N-cyclohexyl-2-(1-thiophen-2-ylethylamino)acetamide
CID 43398121
N-cycloheptyl-2-[1-(5-methylthiophen-2-yl)ethylamino]acetamide
CID 62574010
2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-N-cyclohexylacetamide
CID 81359177
2-chloro-N-cyclohexyl-2-(2-methylphenyl)acetamide
CID 62226466
2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-N-cyclohexylacetamide
CID 81371801

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide?
The IUPAC name of N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide (CID 81363494) is N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide.
What is the SMILES notation for N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide?
The canonical SMILES for N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide is Cc1ccccc1[C@@H](C)NCC(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide?
The InChIKey is HIFGCSWWICWQNH-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H28N2O/c1-14-9-7-8-12-17(14)15(2)19-13-18(21)20-16-10-5-3-4-6-11-16/h7-9,12,15-16,19H,3-6,10-11,13H2,1-2H3,(H,20,21)/t15-/m1/s1.
What are the key properties of N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide?
N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide has a molecular weight of 288.44 g/mol, XLogP of 3.48, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide is sourced from PubChem (CID 81363494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).