4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol

C13H20N2O — CID 23396980

IUPAC4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol
SMILESCc1cc(CNC2CCC(O)CC2)ccn1
InChIInChI=1S/C13H20N2O/c1-10-8-11(6-7-14-10)9-15-12-2-4-13(16)5-3-12/h6-8,12-13,15-16H,2-5,9H2,1H3
InChIKeyGCFMKCRNJWTAKU-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.78
Rot. Bonds3

About 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol

4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol (PubChem CID 23396980) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol
PubChem CID23396980
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol
SMILESCc1cc(CNC2CCC(O)CC2)ccn1
InChIInChI=1S/C13H20N2O/c1-10-8-11(6-7-14-10)9-15-12-2-4-13(16)5-3-12/h6-8,12-13,15-16H,2-5,9H2,1H3
InChIKeyGCFMKCRNJWTAKU-UHFFFAOYSA-N
XLogP1.78
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-methoxy-3-methylphenyl)methylamino]cyclohexan-1-ol
CID 43233134
4-[(cyclopropylamino)methyl]pyridine-2-carbaldehyde
CID 90375224
4-[(3-cyclopropylphenyl)methylamino]cyclohexan-1-ol
CID 79979684
4-[[4-(hydroxymethyl)phenyl]methylamino]cyclohexan-1-ol
CID 107229822
N-cyclopentyl-2-(2-methyl-4-pyridinyl)acetamide
CID 21278987
4-[(4-cyclopropylphenyl)methylamino]cyclohexan-1-ol
CID 79979753
(2-methyl-4-pyridinyl)methylcarbamic acid
CID 89157251
N-[(6-methyl-3-pyridinyl)methyl]cyclopropanamine
CID 43163855
N-[[2-(3,4-dimethylphenoxy)-4-pyridinyl]methyl]cyclopropanamine
CID 62296267
4-(1H-pyrazol-5-ylmethylamino)cyclohexan-1-ol
CID 43662327
4-[[4-(dimethylamino)phenyl]methylamino]cyclohexan-1-ol
CID 43178531
2-[[(4-hydroxycyclohexyl)amino]methyl]-6-methylpyridin-3-ol
CID 78928626

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol?
The IUPAC name of 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol (CID 23396980) is 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol.
What is the SMILES notation for 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol?
The canonical SMILES for 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol is Cc1cc(CNC2CCC(O)CC2)ccn1.
What is the InChIKey of 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol?
The InChIKey is GCFMKCRNJWTAKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-8-11(6-7-14-10)9-15-12-2-4-13(16)5-3-12/h6-8,12-13,15-16H,2-5,9H2,1H3.
What are the key properties of 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol?
4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol has a molecular weight of 220.32 g/mol, XLogP of 1.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol is sourced from PubChem (CID 23396980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).