N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine

C18H30N2O — CID 114342313

IUPACN-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine
SMILESCC1(C)CCC(Oc2cccc(CNC(C)(C)C)n2)CC1
InChIInChI=1S/C18H30N2O/c1-17(2,3)19-13-14-7-6-8-16(20-14)21-15-9-11-18(4,5)12-10-15/h6-8,15,19H,9-13H2,1-5H3
InChIKeyMTLATFHIRUBGBY-UHFFFAOYSA-N
MW290.45 g/mol
LogP4.32
Rot. Bonds4

About N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine

N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine (PubChem CID 114342313) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine
PubChem CID114342313
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine
SMILESCC1(C)CCC(Oc2cccc(CNC(C)(C)C)n2)CC1
InChIInChI=1S/C18H30N2O/c1-17(2,3)19-13-14-7-6-8-16(20-14)21-15-9-11-18(4,5)12-10-15/h6-8,15,19H,9-13H2,1-5H3
InChIKeyMTLATFHIRUBGBY-UHFFFAOYSA-N
XLogP4.32
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(6-cyclopentyloxy-2-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62289891
N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 114342320
2-methyl-N-[[6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]methyl]propan-2-amine
CID 62291642
2-methyl-N-[(6-propoxy-2-pyridinyl)methyl]propan-2-amine
CID 62292233
N-[(6-cyclobutyloxy-2-pyridinyl)methyl]cyclopropanamine
CID 62287510
2-methyl-N-[[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 62291181
N-[[4-[(4,4-dimethylcyclohexyl)oxymethyl]-1,3-thiazol-2-yl]methyl]-2-methylpropan-2-amine
CID 114342496
6-(4,4-dimethylcyclohexyl)oxypyridine-2-carboxylic acid
CID 114340733
N-methyl-1-[6-(3-methylcyclohexyl)oxy-2-pyridinyl]methanamine
CID 62290404
N-[[6-[[cyclobutylmethyl(methyl)amino]methyl]-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106906442
N-[[6-(2-cyclobutylethoxymethyl)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106206102
2-methyl-N-[[6-(oxolan-3-yloxy)-2-pyridinyl]methyl]propan-1-amine
CID 63557509

Frequently Asked Questions

What is the IUPAC name of N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine (CID 114342313) is N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine is CC1(C)CCC(Oc2cccc(CNC(C)(C)C)n2)CC1.
What is the InChIKey of N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine?
The InChIKey is MTLATFHIRUBGBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-17(2,3)19-13-14-7-6-8-16(20-14)21-15-9-11-18(4,5)12-10-15/h6-8,15,19H,9-13H2,1-5H3.
What are the key properties of N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine?
N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine has a molecular weight of 290.45 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 114342313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).