2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide

C19H29N3O2 — CID 94136545

IUPAC2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide
SMILESCC(C)[C@@H](NC(=O)CN(CC(N)=O)C1CCCC1)c1ccccc1
InChIInChI=1S/C19H29N3O2/c1-14(2)19(15-8-4-3-5-9-15)21-18(24)13-22(12-17(20)23)16-10-6-7-11-16/h3-5,8-9,14,16,19H,6-7,10-13H2,1-2H3,(H2,20,23)(H,21,24)/t19-/m1/s1
InChIKeyWBXPLXBBMSRHJH-LJQANCHMSA-N
MW331.46 g/mol
LogP2.23
Rot. Bonds8

About 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide

2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide (PubChem CID 94136545) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide.

Molecular Properties

Compound Name2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide
PubChem CID94136545
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC Name2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide
SMILESCC(C)[C@@H](NC(=O)CN(CC(N)=O)C1CCCC1)c1ccccc1
InChIInChI=1S/C19H29N3O2/c1-14(2)19(15-8-4-3-5-9-15)21-18(24)13-22(12-17(20)23)16-10-6-7-11-16/h3-5,8-9,14,16,19H,6-7,10-13H2,1-2H3,(H2,20,23)(H,21,24)/t19-/m1/s1
InChIKeyWBXPLXBBMSRHJH-LJQANCHMSA-N
XLogP2.23
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopentyl-(2-hydroxy-2-phenylethyl)amino]acetamide
CID 47284555
2-[cyclohexyl(methyl)amino]-N-[(1R)-1-phenylethyl]acetamide
CID 8004439
3-[(2-amino-2-oxoethyl)-cyclopentylamino]-2-phenylpropanoic acid
CID 64567098
2-[4-[cyclohexyl(methyl)sulfamoyl]piperazin-1-yl]-N-(2-methyl-1-phenylpropyl)acetamide
CID 55625884
2-[3-hydroxybutyl(methyl)amino]-N-(2-methyl-1-phenylpropyl)acetamide
CID 111488794
2-amino-N-(2-methyl-1-phenylpropyl)acetamide;hydrochloride
CID 119273385
2-bromo-N-(2-methyl-1-phenylpropyl)acetamide
CID 10492239
2-methyl-3-[methyl-[2-[(2-methyl-1-phenylpropyl)amino]-2-oxoethyl]amino]propanoic acid
CID 122120150
2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide
CID 79322682
2-[azepan-4-yl(methyl)amino]-N-(1-phenylethyl)acetamide
CID 104979577
(E)-N'-cyclohexyl-N'-methyl-N-(2-methyl-1-phenylpropyl)but-2-enediamide
CID 42946351
2-(methylamino)-N-(2-methyl-1-phenylpropyl)acetamide;hydrochloride
CID 119693512

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide?
The IUPAC name of 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide (CID 94136545) is 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide.
What is the SMILES notation for 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide?
The canonical SMILES for 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide is CC(C)[C@@H](NC(=O)CN(CC(N)=O)C1CCCC1)c1ccccc1.
What is the InChIKey of 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide?
The InChIKey is WBXPLXBBMSRHJH-LJQANCHMSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-14(2)19(15-8-4-3-5-9-15)21-18(24)13-22(12-17(20)23)16-10-6-7-11-16/h3-5,8-9,14,16,19H,6-7,10-13H2,1-2H3,(H2,20,23)(H,21,24)/t19-/m1/s1.
What are the key properties of 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide?
2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide has a molecular weight of 331.46 g/mol, XLogP of 2.23, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]amino]acetamide is sourced from PubChem (CID 94136545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).