2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid

C10H18N2O3 — CID 106278391

IUPAC2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid
SMILESCC(C)(CNC(C(=O)O)C1CC1)C(N)=O
InChIInChI=1S/C10H18N2O3/c1-10(2,9(11)15)5-12-7(8(13)14)6-3-4-6/h6-7,12H,3-5H2,1-2H3,(H2,11,15)(H,13,14)
InChIKeyDPFPFIQGVVNZQB-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.05
Rot. Bonds6

About 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid

2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid (PubChem CID 106278391) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid.

Molecular Properties

Compound Name2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid
PubChem CID106278391
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid
SMILESCC(C)(CNC(C(=O)O)C1CC1)C(N)=O
InChIInChI=1S/C10H18N2O3/c1-10(2,9(11)15)5-12-7(8(13)14)6-3-4-6/h6-7,12H,3-5H2,1-2H3,(H2,11,15)(H,13,14)
InChIKeyDPFPFIQGVVNZQB-UHFFFAOYSA-N
XLogP-0.05
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetate
CID 106278452
2-cyclopropyl-2-[(2-methoxy-2-methylpropyl)amino]acetic acid
CID 103266053
2-(4-tert-butylcyclohexyl)-2-(ethylamino)acetic acid
CID 104575539
3-(3-cyclopropylbutanoylamino)-2,2-dimethylpropanamide
CID 56820054
2-[[3-(tert-butylamino)-3-oxopropyl]amino]-2-cyclopropylacetic acid
CID 103263129
2-cyclopropyl-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]acetic acid
CID 103257602
2-[(2-amino-2-methylpropanoyl)amino]-2-cyclopropylacetic acid
CID 62696214
2-cyclopropyl-2-(2,3-dimethylbutylamino)acetic acid
CID 103254407
2-(butylamino)-2-cyclopropylacetic acid
CID 62696417
3-[(1-amino-1-oxobutan-2-yl)amino]-2,2-dimethylpropanamide
CID 106276342
3-(cyclopentylamino)-2,2-dimethylpropanamide
CID 103617377
2-cyclopropyl-2-(3-methylbut-3-enylamino)acetic acid
CID 114473160

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid?
The IUPAC name of 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid (CID 106278391) is 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid.
What is the SMILES notation for 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid?
The canonical SMILES for 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid is CC(C)(CNC(C(=O)O)C1CC1)C(N)=O.
What is the InChIKey of 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid?
The InChIKey is DPFPFIQGVVNZQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-10(2,9(11)15)5-12-7(8(13)14)6-3-4-6/h6-7,12H,3-5H2,1-2H3,(H2,11,15)(H,13,14).
What are the key properties of 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid?
2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid has a molecular weight of 214.26 g/mol, XLogP of -0.05, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-cyclopropylacetic acid is sourced from PubChem (CID 106278391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).