1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol

C14H21NO — CID 79745461

IUPAC1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol
SMILESCCc1ccc(CC2(O)CCC(C)C2)nc1
InChIInChI=1S/C14H21NO/c1-3-12-4-5-13(15-10-12)9-14(16)7-6-11(2)8-14/h4-5,10-11,16H,3,6-9H2,1-2H3
InChIKeyOJICMZWIHICYQD-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.74
Rot. Bonds3

About 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol

1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol (PubChem CID 79745461) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol.

Molecular Properties

Compound Name1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol
PubChem CID79745461
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol
SMILESCCc1ccc(CC2(O)CCC(C)C2)nc1
InChIInChI=1S/C14H21NO/c1-3-12-4-5-13(15-10-12)9-14(16)7-6-11(2)8-14/h4-5,10-11,16H,3,6-9H2,1-2H3
InChIKeyOJICMZWIHICYQD-UHFFFAOYSA-N
XLogP2.74
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(5-ethyl-2-pyridinyl)methyl]-4-methylcyclohexan-1-ol
CID 79740612
1-[(5-ethyl-2-pyridinyl)methyl]-3,4-dimethylcyclohexan-1-ol
CID 79746151
4-tert-butyl-1-[(5-ethyl-2-pyridinyl)methyl]cyclohexan-1-ol
CID 79740383
4-(ethylamino)-1-[(5-ethyl-2-pyridinyl)methyl]cyclohexan-1-ol
CID 79738887
1-[(5-ethyl-2-pyridinyl)methyl]cycloheptan-1-ol
CID 79740505
1-[(5-ethyl-2-pyridinyl)methyl]-2,5-dimethylcyclohexan-1-amine
CID 79745148
1-[(5-ethyl-2-pyridinyl)methyl]-2,4-dimethylcyclohexan-1-amine
CID 79746172
1-[(5-ethyl-2-pyridinyl)methyl]-4-methylcycloheptan-1-amine
CID 79745798
2-(5-ethyl-2-pyridinyl)-1-(1-hydroxy-4-methylcyclohexyl)ethanone
CID 103450762
1-[(5-ethyl-2-pyridinyl)methyl]-3,3,5,5-tetramethylcyclohexan-1-ol
CID 115999401
1-[(5-ethyl-2-pyridinyl)methyl]-2,4,4-trimethylcyclohexan-1-ol
CID 81314333
1-[(5-bromo-2-pyridinyl)methyl]-4-methylcyclohexan-1-ol
CID 104801440

Frequently Asked Questions

What is the IUPAC name of 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol?
The IUPAC name of 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol (CID 79745461) is 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol.
What is the SMILES notation for 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol?
The canonical SMILES for 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol is CCc1ccc(CC2(O)CCC(C)C2)nc1.
What is the InChIKey of 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol?
The InChIKey is OJICMZWIHICYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-3-12-4-5-13(15-10-12)9-14(16)7-6-11(2)8-14/h4-5,10-11,16H,3,6-9H2,1-2H3.
What are the key properties of 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol?
1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-ethyl-2-pyridinyl)methyl]-3-methylcyclopentan-1-ol is sourced from PubChem (CID 79745461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).