(2R)-2-amino-2-methyldec-4-enoic acid

C11H21NO2 — CID 87131405

IUPAC(2R)-2-amino-2-methyldec-4-enoic acid
SMILESCCCCCC=CC[C@@](C)(N)C(=O)O
InChIInChI=1S/C11H21NO2/c1-3-4-5-6-7-8-9-11(2,12)10(13)14/h7-8H,3-6,9,12H2,1-2H3,(H,13,14)/t11-/m1/s1
InChIKeyJKTMCMFPBSUJRO-LLVKDONJSA-N
MW199.29 g/mol
LogP2.32
Rot. Bonds7

About (2R)-2-amino-2-methyldec-4-enoic acid

(2R)-2-amino-2-methyldec-4-enoic acid (PubChem CID 87131405) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is (2R)-2-amino-2-methyldec-4-enoic acid.

Molecular Properties

Compound Name(2R)-2-amino-2-methyldec-4-enoic acid
PubChem CID87131405
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name(2R)-2-amino-2-methyldec-4-enoic acid
SMILESCCCCCC=CC[C@@](C)(N)C(=O)O
InChIInChI=1S/C11H21NO2/c1-3-4-5-6-7-8-9-11(2,12)10(13)14/h7-8H,3-6,9,12H2,1-2H3,(H,13,14)/t11-/m1/s1
InChIKeyJKTMCMFPBSUJRO-LLVKDONJSA-N
XLogP2.32
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(E,2R)-2-amino-2-methyldec-6-enoic acid
CID 102601562
2-amino-2-methyl-3-oxoicos-11-enoic acid
CID 173291281
carbonic acid;(Z)-octadec-9-ene
CID 87599003
(E,2R)-2,6-diamino-2-methylhex-4-enoic acid;methane
CID 159405333
2-hydroxy-2-propylnonadec-4-enoic acid
CID 150727907
acetic acid;(E)-tetradec-7-ene
CID 174697247
19-amino-19-methylheptatriaconta-9,28-diene-18,20-dione
CID 173351868
(11Z,14Z)-2-amino-2-[(9Z,12Z)-octadeca-9,12-dienyl]icosa-11,14-dienoic acid
CID 146620095
2-amino-2-methylpropan-1-ol;(Z)-octadec-9-enoic acid
CID 6441126
carbamic acid;methane;(Z)-tetradec-5-ene
CID 174913616
2,2-dimethylicosa-5,8,11,14-tetraenoic acid
CID 54277636
2,2,3,3-tetramethyloctadec-9-enoic acid
CID 57173563

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-methyldec-4-enoic acid?
The IUPAC name of (2R)-2-amino-2-methyldec-4-enoic acid (CID 87131405) is (2R)-2-amino-2-methyldec-4-enoic acid.
What is the SMILES notation for (2R)-2-amino-2-methyldec-4-enoic acid?
The canonical SMILES for (2R)-2-amino-2-methyldec-4-enoic acid is CCCCCC=CC[C@@](C)(N)C(=O)O.
What is the InChIKey of (2R)-2-amino-2-methyldec-4-enoic acid?
The InChIKey is JKTMCMFPBSUJRO-LLVKDONJSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-4-5-6-7-8-9-11(2,12)10(13)14/h7-8H,3-6,9,12H2,1-2H3,(H,13,14)/t11-/m1/s1.
What are the key properties of (2R)-2-amino-2-methyldec-4-enoic acid?
(2R)-2-amino-2-methyldec-4-enoic acid has a molecular weight of 199.29 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-methyldec-4-enoic acid is sourced from PubChem (CID 87131405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).