N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine

C13H25NO2 — CID 79856400

IUPACN,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine
SMILESCNC1C(OCC2CCOC2)CCC1(C)C
InChIInChI=1S/C13H25NO2/c1-13(2)6-4-11(12(13)14-3)16-9-10-5-7-15-8-10/h10-12,14H,4-9H2,1-3H3
InChIKeyFVHSEOPOFHRXIZ-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.82
Rot. Bonds4

About N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine

N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine (PubChem CID 79856400) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine
PubChem CID79856400
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC NameN,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine
SMILESCNC1C(OCC2CCOC2)CCC1(C)C
InChIInChI=1S/C13H25NO2/c1-13(2)6-4-11(12(13)14-3)16-9-10-5-7-15-8-10/h10-12,14H,4-9H2,1-3H3
InChIKeyFVHSEOPOFHRXIZ-UHFFFAOYSA-N
XLogP1.82
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-5-(oxan-4-ylmethoxy)-N-propylcyclopentan-1-amine
CID 79857761
6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine
CID 79834960
5-ethoxy-N,2,2-trimethylcyclopentan-1-amine
CID 79859712
2-ethoxy-N-methyl-3-(oxolan-3-ylmethoxy)cyclobutan-1-amine
CID 104676439
5-butoxy-N,2,2-trimethylcyclopentan-1-amine
CID 79857081
3-bromo-4-(oxolan-3-ylmethoxy)oxolane
CID 114773818
N,2,2-trimethyl-5-(2-propan-2-yloxyethoxy)cyclopentan-1-amine
CID 79856249
5-(3-methoxy-3-methylbutoxy)-N,2,2-trimethylcyclopentan-1-amine
CID 106665417
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine
CID 82743146
N-methyl-2-(oxan-4-ylmethoxy)cyclopentan-1-amine
CID 62382029
ethane;3-(methoxymethyl)oxolane
CID 143285946
N-methyl-2-[1-(oxolan-3-ylmethoxy)cyclobutyl]ethanamine
CID 103273960

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine?
The IUPAC name of N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine (CID 79856400) is N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine?
The canonical SMILES for N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine is CNC1C(OCC2CCOC2)CCC1(C)C.
What is the InChIKey of N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine?
The InChIKey is FVHSEOPOFHRXIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-13(2)6-4-11(12(13)14-3)16-9-10-5-7-15-8-10/h10-12,14H,4-9H2,1-3H3.
What are the key properties of N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine?
N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine has a molecular weight of 227.35 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-5-(oxolan-3-ylmethoxy)cyclopentan-1-amine is sourced from PubChem (CID 79856400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).