2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide

C15H25N3O — CID 55018380

IUPAC2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide
SMILESCc1ccccc1C(CN)N(CC(N)=O)CC(C)C
InChIInChI=1S/C15H25N3O/c1-11(2)9-18(10-15(17)19)14(8-16)13-7-5-4-6-12(13)3/h4-7,11,14H,8-10,16H2,1-3H3,(H2,17,19)
InChIKeyPPRDBOMFKJPXGP-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.44
Rot. Bonds7

About 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide

2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide (PubChem CID 55018380) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide.

Molecular Properties

Compound Name2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide
PubChem CID55018380
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide
SMILESCc1ccccc1C(CN)N(CC(N)=O)CC(C)C
InChIInChI=1S/C15H25N3O/c1-11(2)9-18(10-15(17)19)14(8-16)13-7-5-4-6-12(13)3/h4-7,11,14H,8-10,16H2,1-3H3,(H2,17,19)
InChIKeyPPRDBOMFKJPXGP-UHFFFAOYSA-N
XLogP1.44
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-amino-1-(2-bromophenyl)ethyl]-(2-methylpropyl)amino]acetamide
CID 55022594
2-[(2-amino-1-phenylethyl)-(2-methylpropyl)amino]acetamide
CID 55017214
(1R)-N,N-diethyl-1-(2-methylphenyl)ethane-1,2-diamine
CID 93489617
2-[[2-amino-1-(3-bromophenyl)ethyl]-(2-methylpropyl)amino]acetamide
CID 55018046
2-[[2-amino-1-(2-bromophenyl)ethyl]-(2-amino-2-oxoethyl)amino]acetamide
CID 55157785
2-[[2-amino-1-(2-methylphenyl)ethyl]-propylamino]ethanol
CID 55018185
2-[[2-amino-1-(2-methylphenyl)ethyl]-(cyanomethyl)amino]acetonitrile
CID 55018035
2-[(2-amino-2-oxoethyl)-[1-(2-hydroxyphenyl)ethyl]amino]acetamide
CID 82980145
2-[(2-amino-1-phenylethyl)-ethylamino]acetamide
CID 103101334
2-[[2-(2-methylphenyl)-2-oxoethyl]-(2-methylpropyl)amino]acetamide
CID 62035855
2-[[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]-(2-methylpropyl)amino]acetamide
CID 62035856
3-methyl-4-(2-methylphenyl)pentanamide
CID 175805571

Frequently Asked Questions

What is the IUPAC name of 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide?
The IUPAC name of 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide (CID 55018380) is 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide.
What is the SMILES notation for 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide?
The canonical SMILES for 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide is Cc1ccccc1C(CN)N(CC(N)=O)CC(C)C.
What is the InChIKey of 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide?
The InChIKey is PPRDBOMFKJPXGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)9-18(10-15(17)19)14(8-16)13-7-5-4-6-12(13)3/h4-7,11,14H,8-10,16H2,1-3H3,(H2,17,19).
What are the key properties of 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide?
2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide has a molecular weight of 263.38 g/mol, XLogP of 1.44, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-amino-1-(2-methylphenyl)ethyl]-(2-methylpropyl)amino]acetamide is sourced from PubChem (CID 55018380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).