2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine

C14H27NO — CID 79351790

IUPAC2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine
SMILESCC1CC(NCC2C(C)(C)C2(C)C)CCO1
InChIInChI=1S/C14H27NO/c1-10-8-11(6-7-16-10)15-9-12-13(2,3)14(12,4)5/h10-12,15H,6-9H2,1-5H3
InChIKeyMCOHNZPFYYGRHV-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.83
Rot. Bonds3

About 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine

2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine (PubChem CID 79351790) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine.

Molecular Properties

Compound Name2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine
PubChem CID79351790
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine
SMILESCC1CC(NCC2C(C)(C)C2(C)C)CCO1
InChIInChI=1S/C14H27NO/c1-10-8-11(6-7-16-10)15-9-12-13(2,3)14(12,4)5/h10-12,15H,6-9H2,1-5H3
InChIKeyMCOHNZPFYYGRHV-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
CID 79352031
2-methyl-N-(3-propoxypropyl)oxan-4-amine
CID 82942441
N-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-ylmethyl)-2-methyloxan-4-amine
CID 79082420
N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cycloheptanamine
CID 66475934
N-[3-[(2-methyloxan-4-yl)amino]propyl]methanesulfonamide
CID 103910287
3-[(2-methyloxan-4-yl)amino]propane-1,2-diol
CID 66177607
2-methyl-N-[(E)-pent-3-enyl]oxan-4-amine
CID 115898630
N-(3-chloro-2-methylprop-2-enyl)-2-methyloxan-4-amine
CID 106438247
N-[(2,2,5,7-tetramethyl-6-oxaspiro[2.5]octan-1-yl)methyl]cyclopropanamine
CID 114229758
3-propan-2-yl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
CID 107448605
N-cyclopropyl-4-[(2-methyloxan-4-yl)amino]butanamide
CID 79393847
1-[(2-methyloxan-4-yl)amino]pentan-2-ol
CID 115898430

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine?
The IUPAC name of 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine (CID 79351790) is 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine.
What is the SMILES notation for 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine?
The canonical SMILES for 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine is CC1CC(NCC2C(C)(C)C2(C)C)CCO1.
What is the InChIKey of 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine?
The InChIKey is MCOHNZPFYYGRHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-10-8-11(6-7-16-10)15-9-12-13(2,3)14(12,4)5/h10-12,15H,6-9H2,1-5H3.
What are the key properties of 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine?
2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine has a molecular weight of 225.38 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine is sourced from PubChem (CID 79351790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).