2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine

C13H27NO — CID 62442194

IUPAC2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine
SMILESCC(C)CNCC(OC1CCC1)C(C)C
InChIInChI=1S/C13H27NO/c1-10(2)8-14-9-13(11(3)4)15-12-6-5-7-12/h10-14H,5-9H2,1-4H3
InChIKeyFSQPSOBPUCLSLB-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.83
Rot. Bonds7

About 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine

2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine (PubChem CID 62442194) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine.

Molecular Properties

Compound Name2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine
PubChem CID62442194
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine
SMILESCC(C)CNCC(OC1CCC1)C(C)C
InChIInChI=1S/C13H27NO/c1-10(2)8-14-9-13(11(3)4)15-12-6-5-7-12/h10-14H,5-9H2,1-4H3
InChIKeyFSQPSOBPUCLSLB-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyloxy-3-methyl-N-propan-2-ylbutan-1-amine
CID 62442191
N-tert-butyl-2-cyclopentyloxy-3-methylbutan-1-amine
CID 62446329
2-(cyclopropylmethoxy)-3-methyl-N-(2-methylpropyl)butan-1-amine
CID 62457054
2-(cyclohexylmethoxy)-3-methyl-N-(2-methylpropyl)butan-1-amine
CID 62486524
N-(2-cyclobutyloxypropyl)-3-methylbutan-1-amine
CID 62583080
CID 175939227
CID 175939227
2-N-cyclopentyl-2-N-ethyl-3-methyl-1-N-(2-methylpropyl)butane-1,2-diamine
CID 55074751
3-amino-2-cyclobutyloxy-4-methylpentan-1-ol
CID 114358246
2,5-dimethylhex-5-en-3-yloxycyclohexane
CID 123198142
N-[(5-cycloheptyloxy-1,3,4-thiadiazol-2-yl)methyl]-2-methylpropan-1-amine
CID 80620557
N-cyclopentyloxy-2-methylpropan-1-amine
CID 83229850
2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride
CID 519535

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine?
The IUPAC name of 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine (CID 62442194) is 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine.
What is the SMILES notation for 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine?
The canonical SMILES for 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine is CC(C)CNCC(OC1CCC1)C(C)C.
What is the InChIKey of 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine?
The InChIKey is FSQPSOBPUCLSLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-10(2)8-14-9-13(11(3)4)15-12-6-5-7-12/h10-14H,5-9H2,1-4H3.
What are the key properties of 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine?
2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine has a molecular weight of 213.36 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-3-methyl-N-(2-methylpropyl)butan-1-amine is sourced from PubChem (CID 62442194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).