2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine

C13H25NO2 — CID 103581014

IUPAC2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine
SMILESCOC(C)(C)CCNC1CCOC1C1CC1
InChIInChI=1S/C13H25NO2/c1-13(2,15-3)7-8-14-11-6-9-16-12(11)10-4-5-10/h10-12,14H,4-9H2,1-3H3
InChIKeyURPIWAXIOGMRSX-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.96
Rot. Bonds6

About 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine

2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine (PubChem CID 103581014) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine
PubChem CID103581014
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine
SMILESCOC(C)(C)CCNC1CCOC1C1CC1
InChIInChI=1S/C13H25NO2/c1-13(2,15-3)7-8-14-11-6-9-16-12(11)10-4-5-10/h10-12,14H,4-9H2,1-3H3
InChIKeyURPIWAXIOGMRSX-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-cyclopropyloxolan-3-yl)amino]-2-methylbutan-2-ol
CID 103580800
2-cyclopropyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]oxolan-3-amine
CID 103580891
tert-butyl 3-[(2-cyclopropyloxolan-3-yl)amino]propanoate
CID 114119970
N-butyl-2-cyclopropyloxolan-3-amine
CID 103580713
N-[2-[(2-cyclopropyloxolan-3-yl)amino]ethyl]acetamide
CID 103580659
N-(cyclobutylmethyl)-2-cyclopropyloxolan-3-amine
CID 103580992
3-(3-methoxy-3-methylbutyl)-N-propyloxan-4-amine
CID 106469455
2-[(3-methoxy-3-methylbutyl)amino]cyclopentane-1-carbonitrile
CID 106675432
4-chloro-N-(3-methoxy-3-methylbutyl)cyclohexan-1-amine
CID 103037173
2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine
CID 103923918
N-(3-methoxy-3-methylbutyl)adamantan-2-amine
CID 106675234
2-cyclopropyl-N-hept-6-enyloxolan-3-amine
CID 107167060

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine?
The IUPAC name of 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine (CID 103581014) is 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine.
What is the SMILES notation for 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine?
The canonical SMILES for 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine is COC(C)(C)CCNC1CCOC1C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine?
The InChIKey is URPIWAXIOGMRSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-13(2,15-3)7-8-14-11-6-9-16-12(11)10-4-5-10/h10-12,14H,4-9H2,1-3H3.
What are the key properties of 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine?
2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine has a molecular weight of 227.35 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine is sourced from PubChem (CID 103581014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).