1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid

C11H22N2O2 — CID 79650269

IUPAC1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid
SMILESCC(C)CN(C)C1CCC(N)(C(=O)O)C1
InChIInChI=1S/C11H22N2O2/c1-8(2)7-13(3)9-4-5-11(12,6-9)10(14)15/h8-9H,4-7,12H2,1-3H3,(H,14,15)
InChIKeyIYDLSTVGOCOBGF-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.91
Rot. Bonds4

About 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid

1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 79650269) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid
PubChem CID79650269
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid
SMILESCC(C)CN(C)C1CCC(N)(C(=O)O)C1
InChIInChI=1S/C11H22N2O2/c1-8(2)7-13(3)9-4-5-11(12,6-9)10(14)15/h8-9H,4-7,12H2,1-3H3,(H,14,15)
InChIKeyIYDLSTVGOCOBGF-UHFFFAOYSA-N
XLogP0.91
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-3-[methyl(3-methylbutan-2-yl)amino]cyclopentane-1-carboxylic acid
CID 79655552
methyl 1-amino-3-[methyl(2-methylpropyl)amino]cyclohexane-1-carboxylate
CID 79636591
1-amino-3-[bis(3-methylbutyl)amino]cyclohexane-1-carboxylic acid
CID 107871020
1-amino-3-[2-methoxyethyl(2-methylpropyl)amino]cyclohexane-1-carboxylic acid
CID 79641945
1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid
CID 79650265
1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide
CID 79649570
1-(ethylamino)-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxamide
CID 79649949
[1-(ethylamino)-3-[methyl(2-methylpropyl)amino]cyclopentyl]methanol
CID 79656684
1-amino-3-(dimethylamino)cyclohexane-1-carboxylic acid
CID 79636513
1-amino-3-(2-methylpropylsulfanyl)cyclopentane-1-carboxylic acid
CID 79654513
1-amino-3-[propan-2-yl(propyl)amino]cyclohexane-1-carboxylic acid
CID 79636910
methyl 1-amino-3-[2-methoxyethyl(2-methylpropyl)amino]cyclopentane-1-carboxylate
CID 79655290

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid (CID 79650269) is 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid is CC(C)CN(C)C1CCC(N)(C(=O)O)C1.
What is the InChIKey of 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is IYDLSTVGOCOBGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-8(2)7-13(3)9-4-5-11(12,6-9)10(14)15/h8-9H,4-7,12H2,1-3H3,(H,14,15).
What are the key properties of 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid?
1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 214.31 g/mol, XLogP of 0.91, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 79650269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).