(2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid

C15H27NO3 — CID 119363910

IUPAC(2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid
SMILESCC(C)C[C@@H](NC(=O)C1(CC(C)C)CCC1)C(=O)O
InChIInChI=1S/C15H27NO3/c1-10(2)8-12(13(17)18)16-14(19)15(6-5-7-15)9-11(3)4/h10-12H,5-9H2,1-4H3,(H,16,19)(H,17,18)/t12-/m1/s1
InChIKeyPOVYUNQQHMLPFA-GFCCVEGCSA-N
MW269.38 g/mol
LogP2.82
Rot. Bonds7

About (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid

(2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid (PubChem CID 119363910) has the molecular formula C15H27NO3 and a molecular weight of 269.38 g/mol. Its IUPAC name is (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid.

Molecular Properties

Compound Name(2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid
PubChem CID119363910
Molecular FormulaC15H27NO3
Molecular Weight269.38 g/mol
Exact Mass269.20
IUPAC Name(2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid
SMILESCC(C)C[C@@H](NC(=O)C1(CC(C)C)CCC1)C(=O)O
InChIInChI=1S/C15H27NO3/c1-10(2)8-12(13(17)18)16-14(19)15(6-5-7-15)9-11(3)4/h10-12H,5-9H2,1-4H3,(H,16,19)(H,17,18)/t12-/m1/s1
InChIKeyPOVYUNQQHMLPFA-GFCCVEGCSA-N
XLogP2.82
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.38
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid with MolForge

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Related Compounds

2-[(1-aminocyclopentanecarbonyl)amino]-4-methylpentanoic acid
CID 61157147
N-(1-bromo-4-methylpentan-2-yl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 114311733
methyl (2S)-2-[[1-(aminomethyl)cyclobutanecarbonyl]amino]-4-methylpentanoate
CID 113358128
(2S)-2-[[4-(aminomethyl)oxane-4-carbonyl]amino]-4-methylpentanoic acid
CID 115439404
N-(4-chloropentan-2-yl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 113376732
N-[(2S)-1-aminopropan-2-yl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 120504549
(2S)-4-methyl-2-[(2-methylthiolane-2-carbonyl)amino]pentanoic acid
CID 81451888
N-but-3-yn-2-yl-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 114390037
(2S)-2-[[2-[(1-benzylcyclobutanecarbonyl)amino]acetyl]amino]-4-methylpentanoic acid
CID 120695756
(2S)-2-hydroxy-3-[[1-(2-methylpropyl)cyclopentanecarbonyl]amino]propanoic acid
CID 107833146
1-(aminomethyl)-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]cyclopentane-1-carboxamide
CID 115434776
2-methyl-1-[1-(2-methylpropyl)cyclohexyl]propan-1-one
CID 58210371

Frequently Asked Questions

What is the IUPAC name of (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid?
The IUPAC name of (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid (CID 119363910) is (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid.
What is the SMILES notation for (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid?
The canonical SMILES for (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid is CC(C)C[C@@H](NC(=O)C1(CC(C)C)CCC1)C(=O)O.
What is the InChIKey of (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid?
The InChIKey is POVYUNQQHMLPFA-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H27NO3/c1-10(2)8-12(13(17)18)16-14(19)15(6-5-7-15)9-11(3)4/h10-12H,5-9H2,1-4H3,(H,16,19)(H,17,18)/t12-/m1/s1.
What are the key properties of (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid?
(2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid has a molecular weight of 269.38 g/mol, XLogP of 2.82, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methyl-2-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pentanoic acid is sourced from PubChem (CID 119363910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).