5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine

C14H27NO — CID 79856523

IUPAC5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine
SMILESCCCNC1C(OC2CCC2)CCC1(C)C
InChIInChI=1S/C14H27NO/c1-4-10-15-13-12(8-9-14(13,2)3)16-11-6-5-7-11/h11-13,15H,4-10H2,1-3H3
InChIKeySAQBJUTUVQSSKF-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.11
Rot. Bonds5

About 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine

5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine (PubChem CID 79856523) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine.

Molecular Properties

Compound Name5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine
PubChem CID79856523
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine
SMILESCCCNC1C(OC2CCC2)CCC1(C)C
InChIInChI=1S/C14H27NO/c1-4-10-15-13-12(8-9-14(13,2)3)16-11-6-5-7-11/h11-13,15H,4-10H2,1-3H3
InChIKeySAQBJUTUVQSSKF-UHFFFAOYSA-N
XLogP3.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-5-[(2-methylpropan-2-yl)oxy]-N-propylcyclopentan-1-amine
CID 79857297
2,2-dimethyl-N-propyl-5-(2,2,2-trifluoroethoxy)cyclopentan-1-amine
CID 79859877
2,2-dimethyl-5-(oxan-4-ylmethoxy)-N-propylcyclopentan-1-amine
CID 79857761
2,2-dimethyl-N-propyl-5-(4,4,4-trifluorobutoxy)cyclopentan-1-amine
CID 82789739
5-(4-ethylphenoxy)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79859799
5-(2-fluoro-3-methylphenoxy)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 107656973
5-(azocan-1-yl)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79865020
6-(2,5-dimethylphenoxy)-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79836581
2,2-dimethyl-N-propyl-6-(2,2,3,3-tetrafluoropropoxy)cyclohexan-1-amine
CID 79836595
5-[(3,4-dimethoxypyrrolidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 103539183
3-(4,4-dimethylcyclohexyl)oxy-2-methoxy-N-propylcyclobutan-1-amine
CID 114342843
5-(2,2-dimethylpyrrolidin-1-yl)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79859592

Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine?
The IUPAC name of 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine (CID 79856523) is 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine.
What is the SMILES notation for 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine?
The canonical SMILES for 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine is CCCNC1C(OC2CCC2)CCC1(C)C.
What is the InChIKey of 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine?
The InChIKey is SAQBJUTUVQSSKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-4-10-15-13-12(8-9-14(13,2)3)16-11-6-5-7-11/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine?
5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine is sourced from PubChem (CID 79856523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).