2,2-dimethylpropanoic acid;pyridin-2-amine

C10H16N2O2 — CID 175228101

IUPAC2,2-dimethylpropanoic acid;pyridin-2-amine
SMILESCC(C)(C)C(=O)O.Nc1ccccn1
InChIInChI=1S/C5H6N2.C5H10O2/c6-5-3-1-2-4-7-5;1-5(2,3)4(6)7/h1-4H,(H2,6,7);1-3H3,(H,6,7)
InChIKeyUIVGETGLLQXNKN-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.78
Rot. Bonds

About 2,2-dimethylpropanoic acid;pyridin-2-amine

2,2-dimethylpropanoic acid;pyridin-2-amine (PubChem CID 175228101) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2,2-dimethylpropanoic acid;pyridin-2-amine.

Molecular Properties

Compound Name2,2-dimethylpropanoic acid;pyridin-2-amine
PubChem CID175228101
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2,2-dimethylpropanoic acid;pyridin-2-amine
SMILESCC(C)(C)C(=O)O.Nc1ccccn1
InChIInChI=1S/C5H6N2.C5H10O2/c6-5-3-1-2-4-7-5;1-5(2,3)4(6)7/h1-4H,(H2,6,7);1-3H3,(H,6,7)
InChIKeyUIVGETGLLQXNKN-UHFFFAOYSA-N
XLogP1.78
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-pyridin-2-ylpropanoic acid
CID 4241373
pyridin-2-amine;3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
CID 158875352
copper pyridin-2-amine
CID 54608459
ethanol;pyridin-2-amine
CID 69424063
CID 160763675
CID 160763675
3-methyl-3-pyridin-2-ylbutanamide
CID 67998308
2-(carbamoylamino)-2-pyridin-2-ylpropanoic acid
CID 70071240
acetic acid;2-(1,1-difluoroethyl)pyridine
CID 174788262
prop-1-ene;bis(pyridin-2-amine)
CID 19911264
ethylbenzene;pyridin-2-amine
CID 145008383
2-cyclopropyl-2-pyridin-2-ylpropanoic acid
CID 70421817
fluoroform;pyridin-2-amine
CID 174867537

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropanoic acid;pyridin-2-amine?
The IUPAC name of 2,2-dimethylpropanoic acid;pyridin-2-amine (CID 175228101) is 2,2-dimethylpropanoic acid;pyridin-2-amine.
What is the SMILES notation for 2,2-dimethylpropanoic acid;pyridin-2-amine?
The canonical SMILES for 2,2-dimethylpropanoic acid;pyridin-2-amine is CC(C)(C)C(=O)O.Nc1ccccn1.
What is the InChIKey of 2,2-dimethylpropanoic acid;pyridin-2-amine?
The InChIKey is UIVGETGLLQXNKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2.C5H10O2/c6-5-3-1-2-4-7-5;1-5(2,3)4(6)7/h1-4H,(H2,6,7);1-3H3,(H,6,7).
What are the key properties of 2,2-dimethylpropanoic acid;pyridin-2-amine?
2,2-dimethylpropanoic acid;pyridin-2-amine has a molecular weight of 196.25 g/mol, XLogP of 1.78, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropanoic acid;pyridin-2-amine is sourced from PubChem (CID 175228101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).