3-cyclobutyloxy-N-methylbutan-1-amine

C9H19NO — CID 114997103

IUPAC3-cyclobutyloxy-N-methylbutan-1-amine
SMILESCNCCC(C)OC1CCC1
InChIInChI=1S/C9H19NO/c1-8(6-7-10-2)11-9-4-3-5-9/h8-10H,3-7H2,1-2H3
InChIKeyHSKXWTYDQSABDJ-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.55
Rot. Bonds5

About 3-cyclobutyloxy-N-methylbutan-1-amine

3-cyclobutyloxy-N-methylbutan-1-amine (PubChem CID 114997103) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 3-cyclobutyloxy-N-methylbutan-1-amine.

Molecular Properties

Compound Name3-cyclobutyloxy-N-methylbutan-1-amine
PubChem CID114997103
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name3-cyclobutyloxy-N-methylbutan-1-amine
SMILESCNCCC(C)OC1CCC1
InChIInChI=1S/C9H19NO/c1-8(6-7-10-2)11-9-4-3-5-9/h8-10H,3-7H2,1-2H3
InChIKeyHSKXWTYDQSABDJ-UHFFFAOYSA-N
XLogP1.55
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 ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

rac-(1r,3r)-3-methoxy-N-methylcyclobutan-1-amine
CID 55295891
Methyl[3-(propan-2-yloxy)propyl]amine
CID 19842664
N-methyl-3-(4,4,4-trifluorobutoxy)cyclobutan-1-amine
CID 82794411
3-ethoxy-N-(3-fluoropropyl)cyclobutan-1-amine
CID 103917820
N-(3-fluoropropyl)-3-methoxycyclobutan-1-amine
CID 104871909
3-ethoxy-N-(2-fluoroethyl)cyclobutan-1-amine
CID 105841914
N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine
CID 131224112
(3-Cyclobutoxy-2,2-difluoropropyl)(ethyl)amine
CID 165467338
(3-Cyclobutoxy-2,2-difluoropropyl)(propyl)amine
CID 165955969
2-Fluoro-N-(3-isopropoxypropyl)cyclobutan-1-amine
CID 168021635
Methanidyl(3-propan-2-yloxypropyl)azanium
CID 20723367
3-butoxy-N-methylpropan-1-amine
CID 23516892

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyloxy-N-methylbutan-1-amine?
The IUPAC name of 3-cyclobutyloxy-N-methylbutan-1-amine (CID 114997103) is 3-cyclobutyloxy-N-methylbutan-1-amine.
What is the SMILES notation for 3-cyclobutyloxy-N-methylbutan-1-amine?
The canonical SMILES for 3-cyclobutyloxy-N-methylbutan-1-amine is CNCCC(C)OC1CCC1.
What is the InChIKey of 3-cyclobutyloxy-N-methylbutan-1-amine?
The InChIKey is HSKXWTYDQSABDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(6-7-10-2)11-9-4-3-5-9/h8-10H,3-7H2,1-2H3.
What are the key properties of 3-cyclobutyloxy-N-methylbutan-1-amine?
3-cyclobutyloxy-N-methylbutan-1-amine has a molecular weight of 157.26 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyloxy-N-methylbutan-1-amine is sourced from PubChem (CID 114997103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).