(5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol

C14H21NO — CID 115827962

IUPAC(5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol
SMILESCc1cncc(C(O)C2C(C)(C)C2(C)C)c1
InChIInChI=1S/C14H21NO/c1-9-6-10(8-15-7-9)11(16)12-13(2,3)14(12,4)5/h6-8,11-12,16H,1-5H3
InChIKeyKYYXYVYLPMICTM-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.11
Rot. Bonds2

About (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol

(5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol (PubChem CID 115827962) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol.

Molecular Properties

Compound Name(5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol
PubChem CID115827962
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name(5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol
SMILESCc1cncc(C(O)C2C(C)(C)C2(C)C)c1
InChIInChI=1S/C14H21NO/c1-9-6-10(8-15-7-9)11(16)12-13(2,3)14(12,4)5/h6-8,11-12,16H,1-5H3
InChIKeyKYYXYVYLPMICTM-UHFFFAOYSA-N
XLogP3.11
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol?
The IUPAC name of (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol (CID 115827962) is (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol.
What is the SMILES notation for (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol?
The canonical SMILES for (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol is Cc1cncc(C(O)C2C(C)(C)C2(C)C)c1.
What is the InChIKey of (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol?
The InChIKey is KYYXYVYLPMICTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-9-6-10(8-15-7-9)11(16)12-13(2,3)14(12,4)5/h6-8,11-12,16H,1-5H3.
What are the key properties of (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol?
(5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol has a molecular weight of 219.33 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methanol is sourced from PubChem (CID 115827962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).