(2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid

C10H20N2O4 — CID 150012151

IUPAC(2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid
SMILESCC(C)(C)OC(=O)C(CCN)[C@@H](N)C(=O)O
InChIInChI=1S/C10H20N2O4/c1-10(2,3)16-9(15)6(4-5-11)7(12)8(13)14/h6-7H,4-5,11-12H2,1-3H3,(H,13,14)/t6?,7-/m1/s1
InChIKeyDDMUWSISECXMAB-COBSHVIPSA-N
MW232.28 g/mol
LogP-0.29
Rot. Bonds5

About (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid

(2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid (PubChem CID 150012151) has the molecular formula C10H20N2O4 and a molecular weight of 232.28 g/mol. Its IUPAC name is (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid.

Molecular Properties

Compound Name(2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid
PubChem CID150012151
Molecular FormulaC10H20N2O4
Molecular Weight232.28 g/mol
Exact Mass232.14
IUPAC Name(2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid
SMILESCC(C)(C)OC(=O)C(CCN)[C@@H](N)C(=O)O
InChIInChI=1S/C10H20N2O4/c1-10(2,3)16-9(15)6(4-5-11)7(12)8(13)14/h6-7H,4-5,11-12H2,1-3H3,(H,13,14)/t6?,7-/m1/s1
InChIKeyDDMUWSISECXMAB-COBSHVIPSA-N
XLogP-0.29
TPSA115.64 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

ditert-butyl 2-amino-3-(aminomethyl)butanedioate
CID 154956810
tert-butyl (2R)-2,6-diaminohexanoate
CID 92978498
tert-butyl 4-amino-2-bromobutanoate
CID 57000129
(2R)-2-amino-3-[(4-fluorophenyl)methyl]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
CID 118878667
(2R)-2-amino-3-[(4-bromophenyl)methyl]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
CID 140580984
tert-butyl 2-amino-5-fluoropentanoate
CID 5323645
(2R)-2-amino-4,4,4-trifluoro-3-[(2-methylpropan-2-yl)oxycarbonyl]butanoic acid
CID 170905684
2-amino-3-methoxycarbonyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
CID 175598067
2-[1-amino-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]pent-4-enoic acid
CID 87779163
(2R,3R)-7,7,7-trifluoro-3-[(2-methylpropan-2-yl)oxycarbonyl]-2-(4,4,4-trifluorobutyl)heptanoic acid
CID 154451126
(2S,3S)-2-amino-3-methyl-6-[(2-methylpropan-2-yl)oxy]-6-oxohexanoic acid
CID 54069607
tert-butyl (2R)-2-aminobutanoate
CID 13283520

Frequently Asked Questions

What is the IUPAC name of (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid?
The IUPAC name of (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid (CID 150012151) is (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid.
What is the SMILES notation for (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid?
The canonical SMILES for (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid is CC(C)(C)OC(=O)C(CCN)[C@@H](N)C(=O)O.
What is the InChIKey of (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid?
The InChIKey is DDMUWSISECXMAB-COBSHVIPSA-N. The full InChI is InChI=1S/C10H20N2O4/c1-10(2,3)16-9(15)6(4-5-11)7(12)8(13)14/h6-7H,4-5,11-12H2,1-3H3,(H,13,14)/t6?,7-/m1/s1.
What are the key properties of (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid?
(2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid has a molecular weight of 232.28 g/mol, XLogP of -0.29, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2,5-diamino-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanoic acid is sourced from PubChem (CID 150012151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).