N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide

C20H30N2O2 — CID 55828921

IUPACN-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide
SMILESCOc1ccccc1CN(CC(=O)NCC1CCCCC1)C1CC1
InChIInChI=1S/C20H30N2O2/c1-24-19-10-6-5-9-17(19)14-22(18-11-12-18)15-20(23)21-13-16-7-3-2-4-8-16/h5-6,9-10,16,18H,2-4,7-8,11-15H2,1H3,(H,21,23)
InChIKeyHUIYRAUBOBFOQZ-UHFFFAOYSA-N
MW330.47 g/mol
LogP3.36
Rot. Bonds8

About N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide

N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide (PubChem CID 55828921) has the molecular formula C20H30N2O2 and a molecular weight of 330.47 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide
PubChem CID55828921
Molecular FormulaC20H30N2O2
Molecular Weight330.47 g/mol
Exact Mass330.23
IUPAC NameN-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide
SMILESCOc1ccccc1CN(CC(=O)NCC1CCCCC1)C1CC1
InChIInChI=1S/C20H30N2O2/c1-24-19-10-6-5-9-17(19)14-22(18-11-12-18)15-20(23)21-13-16-7-3-2-4-8-16/h5-6,9-10,16,18H,2-4,7-8,11-15H2,1H3,(H,21,23)
InChIKeyHUIYRAUBOBFOQZ-UHFFFAOYSA-N
XLogP3.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-[cyclopentyl-[(2-methoxyphenyl)methyl]amino]acetyl]amino]benzamide
CID 91838731
2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide
CID 60513356
N-(cyclohexylmethyl)-2-(2-methoxyphenoxy)acetamide
CID 2083257
2-[(2-aminophenyl)methyl-cyclopropylamino]-N-ethylacetamide
CID 43384134
2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide
CID 55827221
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-propan-2-ylacetamide
CID 34979795
3-cyclopentyl-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 78779689
2-[acetyl-[(2-methoxyphenyl)methyl]amino]-N-cycloheptylacetamide
CID 113162917
2-[(2-methoxyphenyl)methyl-[1-(2-methoxyphenyl)piperidin-4-yl]amino]acetic acid
CID 110161396
N-(2-bromoethyl)-N-[(2-methoxyphenyl)methyl]cyclopropanamine
CID 80666884
2-[[(cyclohexylmethylamino)-[2-(2-methoxyphenyl)ethylamino]methylidene]amino]-N,N-dimethylacetamide;hydroiodide
CID 111861499
methyl 5-[[cyclopropyl-[(2-methoxyphenyl)methyl]amino]methyl]-2-methylfuran-3-carboxylate
CID 78899184

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide?
The IUPAC name of N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide (CID 55828921) is N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide.
What is the SMILES notation for N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide?
The canonical SMILES for N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide is COc1ccccc1CN(CC(=O)NCC1CCCCC1)C1CC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide?
The InChIKey is HUIYRAUBOBFOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O2/c1-24-19-10-6-5-9-17(19)14-22(18-11-12-18)15-20(23)21-13-16-7-3-2-4-8-16/h5-6,9-10,16,18H,2-4,7-8,11-15H2,1H3,(H,21,23).
What are the key properties of N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide?
N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide has a molecular weight of 330.47 g/mol, XLogP of 3.36, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide is sourced from PubChem (CID 55828921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).