3-cyclobutyl-2-methoxy-N-methylpropan-1-amine

C9H19NO — CID 105430802

IUPAC3-cyclobutyl-2-methoxy-N-methylpropan-1-amine
SMILESCNCC(CC1CCC1)OC
InChIInChI=1S/C9H19NO/c1-10-7-9(11-2)6-8-4-3-5-8/h8-10H,3-7H2,1-2H3
InChIKeyZBBPJNCPTYHQIP-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.41
Rot. Bonds5

About 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine

3-cyclobutyl-2-methoxy-N-methylpropan-1-amine (PubChem CID 105430802) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclobutyl-2-methoxy-N-methylpropan-1-amine
PubChem CID105430802
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name3-cyclobutyl-2-methoxy-N-methylpropan-1-amine
SMILESCNCC(CC1CCC1)OC
InChIInChI=1S/C9H19NO/c1-10-7-9(11-2)6-8-4-3-5-8/h8-10H,3-7H2,1-2H3
InChIKeyZBBPJNCPTYHQIP-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-2-(difluoromethoxy)-N-methylethanamine
CID 84718112
2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine
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2-Hexan-2-ylmorpholine
CID 18331948
2-methyl-N-(oxan-2-ylmethyl)pentan-1-amine
CID 61609432
2-(Heptan-4-yl)morpholine
CID 68590407
2-methoxy-N,4-dimethylhexan-3-amine
CID 79616095
(2-Cyclohexyl-2-methoxyethyl)(methyl)amine
CID 83827257
(2R,4R)-2-methoxy-N,4-dimethylhexan-3-amine
CID 89339327
6-[[(3-Ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine
CID 91427984
2-methoxy-N,4-dimethylpentan-1-amine
CID 112709380
2-methoxy-N,7-dimethylnonan-3-amine
CID 123313653
3-methoxy-N,4-dimethylhexan-2-amine
CID 123605445

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine?
The IUPAC name of 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine (CID 105430802) is 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine is CNCC(CC1CCC1)OC.
What is the InChIKey of 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine?
The InChIKey is ZBBPJNCPTYHQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-10-7-9(11-2)6-8-4-3-5-8/h8-10H,3-7H2,1-2H3.
What are the key properties of 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine?
3-cyclobutyl-2-methoxy-N-methylpropan-1-amine has a molecular weight of 157.26 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-2-methoxy-N-methylpropan-1-amine is sourced from PubChem (CID 105430802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).