3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol

C16H27NO2 — CID 64737262

IUPAC3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol
SMILESCc1occc1CN(C)CC1C(C)CC(C)CC1O
InChIInChI=1S/C16H27NO2/c1-11-7-12(2)15(16(18)8-11)10-17(4)9-14-5-6-19-13(14)3/h5-6,11-12,15-16,18H,7-10H2,1-4H3
InChIKeyGTPYIBBMOCYILQ-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.06
Rot. Bonds4

About 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol

3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol (PubChem CID 64737262) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol
PubChem CID64737262
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol
SMILESCc1occc1CN(C)CC1C(C)CC(C)CC1O
InChIInChI=1S/C16H27NO2/c1-11-7-12(2)15(16(18)8-11)10-17(4)9-14-5-6-19-13(14)3/h5-6,11-12,15-16,18H,7-10H2,1-4H3
InChIKeyGTPYIBBMOCYILQ-UHFFFAOYSA-N
XLogP3.06
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

2-[[furan-2-ylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-ol
CID 64734697
3,5-dimethyl-2-[[methyl-[(4-methylphenyl)methyl]amino]methyl]cyclohexan-1-ol
CID 64736267
4-methyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-one
CID 55094882
N-methyl-4-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]oxolan-3-amine
CID 66245971
N-methyl-N-[(2-methylfuran-3-yl)methyl]hydroxylamine
CID 96732982
3,5-dimethyl-2-[[methyl(2-phenylethyl)amino]methyl]cyclohexan-1-ol
CID 65486914
2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 55094127
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
CID 61370638
2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62707768
3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 64736070
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]cyclohexan-1-ol
CID 61426304
trans-(1S,2S)-2-[methyl-[(2-methylfuran-3-yl)methyl]amino]cyclohexan-1-ol
CID 102731964

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol?
The IUPAC name of 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol (CID 64737262) is 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol is Cc1occc1CN(C)CC1C(C)CC(C)CC1O.
What is the InChIKey of 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol?
The InChIKey is GTPYIBBMOCYILQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-11-7-12(2)15(16(18)8-11)10-17(4)9-14-5-6-19-13(14)3/h5-6,11-12,15-16,18H,7-10H2,1-4H3.
What are the key properties of 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol?
3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol has a molecular weight of 265.40 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 64737262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).