4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine

C14H29NO — CID 103032388

IUPAC4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine
SMILESCNC(CCC(C)(C)OC)C1(C)CCCC1
InChIInChI=1S/C14H29NO/c1-13(2,16-5)11-8-12(15-4)14(3)9-6-7-10-14/h12,15H,6-11H2,1-5H3
InChIKeyQGDNPISYEDOXRT-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.36
Rot. Bonds6

About 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine

4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine (PubChem CID 103032388) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine.

Molecular Properties

Compound Name4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine
PubChem CID103032388
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine
SMILESCNC(CCC(C)(C)OC)C1(C)CCCC1
InChIInChI=1S/C14H29NO/c1-13(2,16-5)11-8-12(15-4)14(3)9-6-7-10-14/h12,15H,6-11H2,1-5H3
InChIKeyQGDNPISYEDOXRT-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine?
The IUPAC name of 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine (CID 103032388) is 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine.
What is the SMILES notation for 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine?
The canonical SMILES for 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine is CNC(CCC(C)(C)OC)C1(C)CCCC1.
What is the InChIKey of 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine?
The InChIKey is QGDNPISYEDOXRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-13(2,16-5)11-8-12(15-4)14(3)9-6-7-10-14/h12,15H,6-11H2,1-5H3.
What are the key properties of 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine?
4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine has a molecular weight of 227.39 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine is sourced from PubChem (CID 103032388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).