trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride

C6H14ClNO — CID 155973487

IUPACtrans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride
SMILESCN[C@@H]1CC[C@H]1OC.Cl
InChIInChI=1S/C6H13NO.ClH/c1-7-5-3-4-6(5)8-2;/h5-7H,3-4H2,1-2H3;1H/t5-,6-;/m1./s1
InChIKeyRRTIRTUGQVRYTQ-KGZKBUQUSA-N
MW151.64 g/mol
LogP0.81
Rot. Bonds2

About trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride

trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride (PubChem CID 155973487) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride.

Molecular Properties

Compound Nametrans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride
PubChem CID155973487
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Nametrans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride
SMILESCN[C@@H]1CC[C@H]1OC.Cl
InChIInChI=1S/C6H13NO.ClH/c1-7-5-3-4-6(5)8-2;/h5-7H,3-4H2,1-2H3;1H/t5-,6-;/m1./s1
InChIKeyRRTIRTUGQVRYTQ-KGZKBUQUSA-N
XLogP0.81
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 58216275
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4-methoxy-N,2-dimethylcyclohexan-1-amine
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(3R,4R)-4-methoxy-N,1-dimethylpyrrolidin-3-amine
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2,6-dimethoxy-9-azabicyclo[3.3.1]nonane;hydrochloride
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cis-(1R,2S)-2-methoxy-N-propan-2-ylcyclopentan-1-amine
CID 94347863
2-methoxy-N-propan-2-ylcyclopentan-1-amine
CID 62088372
2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,4-dimethylcyclohexan-1-amine
CID 102721871
2-(3,5-dimethylcyclohexyl)oxy-N-methylcyclohexan-1-amine
CID 64728780
2-(3,4-dimethoxypyrrolidin-1-yl)-N-methyl-4-propylcyclohexan-1-amine
CID 103532456
4-fluoro-3-methoxy-N-methylcyclohexan-1-amine
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N-ethyl-2-methoxycyclopentan-1-amine
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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride?
The IUPAC name of trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride (CID 155973487) is trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride.
What is the SMILES notation for trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride?
The canonical SMILES for trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride is CN[C@@H]1CC[C@H]1OC.Cl.
What is the InChIKey of trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride?
The InChIKey is RRTIRTUGQVRYTQ-KGZKBUQUSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-7-5-3-4-6(5)8-2;/h5-7H,3-4H2,1-2H3;1H/t5-,6-;/m1./s1.
What are the key properties of trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride?
trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-methoxy-N-methylcyclobutan-1-amine;hydrochloride is sourced from PubChem (CID 155973487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).