2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid

C11H24N2O2 — CID 64727236

IUPAC2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid
SMILESCCNC(C)(CC(C)N(C)CC)C(=O)O
InChIInChI=1S/C11H24N2O2/c1-6-12-11(4,10(14)15)8-9(3)13(5)7-2/h9,12H,6-8H2,1-5H3,(H,14,15)
InChIKeyGDPABLZULZOVEM-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.17
Rot. Bonds7

About 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid

2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid (PubChem CID 64727236) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid.

Molecular Properties

Compound Name2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid
PubChem CID64727236
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid
SMILESCCNC(C)(CC(C)N(C)CC)C(=O)O
InChIInChI=1S/C11H24N2O2/c1-6-12-11(4,10(14)15)8-9(3)13(5)7-2/h9,12H,6-8H2,1-5H3,(H,14,15)
InChIKeyGDPABLZULZOVEM-UHFFFAOYSA-N
XLogP1.17
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[ethyl(methyl)amino]-2-methyl-2-(propylamino)pentanoic acid
CID 64727424
4-[ethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 64727241
4-[3-(dimethylamino)propyl-ethylamino]-2-(ethylamino)-2-methylpentanoic acid
CID 102996545
4-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-2-(ethylamino)-2-methylpentanoic acid
CID 105416931
4-[cyclopentyl(methyl)amino]-2-(ethylamino)-2-methylpentanoic acid
CID 64728207
2-methyl-4-[methyl(2-methylpropyl)amino]-2-(propylamino)pentanoic acid
CID 64725842
4-[cycloheptyl(methyl)amino]-2-(ethylamino)-2-methylpentanoic acid
CID 64710589
2-(ethylamino)-4-methoxy-2-methylpentanoic acid
CID 64709074
2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentan-1-ol
CID 64797008
2-methyl-2-(methylamino)-4-[methyl(2-methylbutyl)amino]pentanoic acid
CID 64711907
2-(ethylamino)-2-methyl-4-(3,3,3-trifluoropropoxy)pentanoic acid
CID 82958128
methyl 2-(ethylamino)-2-methyl-4-[methyl(2,2,2-trifluoroethyl)amino]pentanoate
CID 64711767

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid?
The IUPAC name of 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid (CID 64727236) is 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid.
What is the SMILES notation for 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid?
The canonical SMILES for 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid is CCNC(C)(CC(C)N(C)CC)C(=O)O.
What is the InChIKey of 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid?
The InChIKey is GDPABLZULZOVEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-6-12-11(4,10(14)15)8-9(3)13(5)7-2/h9,12H,6-8H2,1-5H3,(H,14,15).
What are the key properties of 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid?
2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid has a molecular weight of 216.32 g/mol, XLogP of 1.17, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-[ethyl(methyl)amino]-2-methylpentanoic acid is sourced from PubChem (CID 64727236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).