2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol

C12H18N2O — CID 112634209

IUPAC2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol
SMILESCc1ccc(NC2CC(O)C2(C)C)cn1
InChIInChI=1S/C12H18N2O/c1-8-4-5-9(7-13-8)14-10-6-11(15)12(10,2)3/h4-5,7,10-11,14-15H,6H2,1-3H3
InChIKeyZCPZARFUZKEVLD-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.96
Rot. Bonds2

About 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol

2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol (PubChem CID 112634209) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol
PubChem CID112634209
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol
SMILESCc1ccc(NC2CC(O)C2(C)C)cn1
InChIInChI=1S/C12H18N2O/c1-8-4-5-9(7-13-8)14-10-6-11(15)12(10,2)3/h4-5,7,10-11,14-15H,6H2,1-3H3
InChIKeyZCPZARFUZKEVLD-UHFFFAOYSA-N
XLogP1.96
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-3-[[6-(trifluoromethyl)-3-pyridinyl]amino]cyclobutan-1-ol
CID 112634249
2,2-dimethyl-3-[(2-phenylpyrimidin-5-yl)amino]cyclobutan-1-ol
CID 115972266
N-(2,2-dimethylcyclobutyl)-6-methylpyridin-3-amine
CID 130532978
2,2-dimethyl-3-(pyrimidin-5-ylamino)cyclobutan-1-ol
CID 107587633
3-(4-amino-3-methylanilino)-2,2-dimethylcyclobutan-1-ol
CID 114628567
2,2-dimethyl-3-[(5-methyl-3-pyridinyl)amino]cyclobutan-1-ol
CID 103952292
3-(3,4-diaminoanilino)-2,2-dimethylcyclobutan-1-ol
CID 106751240
2,2-dimethyl-3-(4-propan-2-ylanilino)cyclobutan-1-ol
CID 112633171
3-[(3-amino-6-methyl-2-pyridinyl)amino]-2,2-dimethylcyclobutan-1-ol
CID 114628760
3-(3-iodo-4-methylanilino)-2,2-dimethylcyclobutan-1-ol
CID 112633569
2,2-dimethyl-3-[4-(triazol-2-yl)anilino]cyclobutan-1-ol
CID 112633683
3-(3-amino-4-methylanilino)-2,2-dimethylcyclobutan-1-ol
CID 114628749

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol?
The IUPAC name of 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol (CID 112634209) is 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol is Cc1ccc(NC2CC(O)C2(C)C)cn1.
What is the InChIKey of 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol?
The InChIKey is ZCPZARFUZKEVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-8-4-5-9(7-13-8)14-10-6-11(15)12(10,2)3/h4-5,7,10-11,14-15H,6H2,1-3H3.
What are the key properties of 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol?
2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol has a molecular weight of 206.29 g/mol, XLogP of 1.96, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-[(6-methyl-3-pyridinyl)amino]cyclobutan-1-ol is sourced from PubChem (CID 112634209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).