2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide

C18H26N2O2 — CID 110892135

IUPAC2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide
SMILESCc1ccc(C(NC(=O)CN(CCO)C2CC2)C2CC2)cc1
InChIInChI=1S/C18H26N2O2/c1-13-2-4-14(5-3-13)18(15-6-7-15)19-17(22)12-20(10-11-21)16-8-9-16/h2-5,15-16,18,21H,6-12H2,1H3,(H,19,22)
InChIKeyDLRJLIBQJFLIGE-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.02
Rot. Bonds8

About 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide

2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide (PubChem CID 110892135) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide
PubChem CID110892135
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide
SMILESCc1ccc(C(NC(=O)CN(CCO)C2CC2)C2CC2)cc1
InChIInChI=1S/C18H26N2O2/c1-13-2-4-14(5-3-13)18(15-6-7-15)19-17(22)12-20(10-11-21)16-8-9-16/h2-5,15-16,18,21H,6-12H2,1H3,(H,19,22)
InChIKeyDLRJLIBQJFLIGE-UHFFFAOYSA-N
XLogP2.02
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl(phenyl)methyl]acetamide
CID 110899428
1-cyclopropyl-3-[(S)-cyclopropyl-(4-methylphenyl)methyl]-1-(2-hydroxyethyl)urea
CID 96534331
2-[cyclopropyl-[3-(methylamino)-3-(4-methylphenyl)propyl]amino]ethanol
CID 55099042
2-(azepan-1-yl)-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide
CID 46526961
2-[cyclopropyl(2-hydroxyethyl)amino]-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]acetamide
CID 110906790
2-[cyclopropyl(2-hydroxyethyl)amino]-N-(1-thiophen-2-ylethyl)acetamide
CID 60967061
2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 55210363
N'-cyclopropyl-N-[cyclopropyl-(4-methylphenyl)methyl]-N'-ethylethane-1,2-diamine
CID 103910587
N-[cyclopropyl-(4-methylphenyl)methyl]-2-phenoxyacetamide
CID 51296315
2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 60775079
methyl 2-[[2-[[cyclopropyl-(4-methylphenyl)methyl]amino]-2-oxoethyl]-methylamino]-2-(3,4,5-trifluorophenyl)acetate
CID 71851891
2-[cyclopropyl(2-hydroxyethyl)amino]-1-(4-propan-2-ylphenyl)ethanone
CID 62031291

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide?
The IUPAC name of 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide (CID 110892135) is 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide is Cc1ccc(C(NC(=O)CN(CCO)C2CC2)C2CC2)cc1.
What is the InChIKey of 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide?
The InChIKey is DLRJLIBQJFLIGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-13-2-4-14(5-3-13)18(15-6-7-15)19-17(22)12-20(10-11-21)16-8-9-16/h2-5,15-16,18,21H,6-12H2,1H3,(H,19,22).
What are the key properties of 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide?
2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide has a molecular weight of 302.42 g/mol, XLogP of 2.02, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(2-hydroxyethyl)amino]-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide is sourced from PubChem (CID 110892135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).