2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid

C14H28N2O3 — CID 64710862

IUPAC2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid
SMILESCCN(CCOC)C(C)CC(C)(NC1CC1)C(=O)O
InChIInChI=1S/C14H28N2O3/c1-5-16(8-9-19-4)11(2)10-14(3,13(17)18)15-12-6-7-12/h11-12,15H,5-10H2,1-4H3,(H,17,18)
InChIKeyYEGGAQLMJSBVPZ-UHFFFAOYSA-N
MW272.39 g/mol
LogP1.33
Rot. Bonds10

About 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid

2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid (PubChem CID 64710862) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid
PubChem CID64710862
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC Name2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid
SMILESCCN(CCOC)C(C)CC(C)(NC1CC1)C(=O)O
InChIInChI=1S/C14H28N2O3/c1-5-16(8-9-19-4)11(2)10-14(3,13(17)18)15-12-6-7-12/h11-12,15H,5-10H2,1-4H3,(H,17,18)
InChIKeyYEGGAQLMJSBVPZ-UHFFFAOYSA-N
XLogP1.33
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[cyclobutylmethyl(ethyl)amino]-2-(cyclopropylamino)-2-methylpentanoic acid
CID 107401068
methyl 4-[butyl(ethyl)amino]-2-(cyclopropylamino)-2-methylpentanoate
CID 64727139
2-(cyclopropylamino)-4-[cyclopropyl(ethyl)amino]-2-methylpentanoic acid
CID 64728237
2-(cyclopropylamino)-2-methyl-4-[methyl(3-methylbutyl)amino]pentanoic acid
CID 64711089
4-[cyclopropyl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 64709693
2-(cyclopropylamino)-4-[1-cyclopropylethyl(methyl)amino]-2-methylpentanoic acid
CID 64710762
2-(cyclopropylamino)-4-[cyclopropylmethyl(ethyl)amino]-2-methylpentanamide
CID 64702637
2-(cyclopropylamino)-3-[3-methoxypropyl(methyl)amino]-2-methylpropanoic acid
CID 55141472
2-amino-4-[bis(2-methoxyethyl)amino]-2-methylpentanoic acid
CID 64709529
2-(cyclopropylamino)-4-[ethyl(2,2,2-trifluoroethyl)amino]-2-methylpentanamide
CID 64711790
ethyl 2-(cyclopropylamino)-4-(dipropylamino)-2-methylpentanoate
CID 64726602
2-(cyclopropylamino)-5-[2-methoxyethyl(propan-2-yl)amino]-2-methylpentanamide
CID 82960589

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid?
The IUPAC name of 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid (CID 64710862) is 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid.
What is the SMILES notation for 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid?
The canonical SMILES for 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid is CCN(CCOC)C(C)CC(C)(NC1CC1)C(=O)O.
What is the InChIKey of 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid?
The InChIKey is YEGGAQLMJSBVPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-5-16(8-9-19-4)11(2)10-14(3,13(17)18)15-12-6-7-12/h11-12,15H,5-10H2,1-4H3,(H,17,18).
What are the key properties of 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid?
2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid has a molecular weight of 272.39 g/mol, XLogP of 1.33, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid is sourced from PubChem (CID 64710862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).