5-butyl-6-(methoxymethyl)decan-5-amine

C16H35NO — CID 87262947

IUPAC5-butyl-6-(methoxymethyl)decan-5-amine
SMILESCCCCC(COC)C(N)(CCCC)CCCC
InChIInChI=1S/C16H35NO/c1-5-8-11-15(14-18-4)16(17,12-9-6-2)13-10-7-3/h15H,5-14,17H2,1-4H3
InChIKeyYHVSBNFUUPPWQM-UHFFFAOYSA-N
MW257.46 g/mol
LogP4.52
Rot. Bonds12

About 5-butyl-6-(methoxymethyl)decan-5-amine

5-butyl-6-(methoxymethyl)decan-5-amine (PubChem CID 87262947) has the molecular formula C16H35NO and a molecular weight of 257.46 g/mol. Its IUPAC name is 5-butyl-6-(methoxymethyl)decan-5-amine.

Molecular Properties

Compound Name5-butyl-6-(methoxymethyl)decan-5-amine
PubChem CID87262947
Molecular FormulaC16H35NO
Molecular Weight257.46 g/mol
Exact Mass257.27
IUPAC Name5-butyl-6-(methoxymethyl)decan-5-amine
SMILESCCCCC(COC)C(N)(CCCC)CCCC
InChIInChI=1S/C16H35NO/c1-5-8-11-15(14-18-4)16(17,12-9-6-2)13-10-7-3/h15H,5-14,17H2,1-4H3
InChIKeyYHVSBNFUUPPWQM-UHFFFAOYSA-N
XLogP4.52
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.46
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 109375
CID 109375
CID 3014707
CID 3014707
CID 18354016
CID 18354016
CID 19027516
CID 19027516
CID 54315589
CID 54315589
CID 54453995
CID 54453995
CID 57296414
CID 57296414
CID 87131528
CID 87131528
CID 87131556
CID 87131556
CID 87133239
CID 87133239
CID 87354211
CID 87354211
CID 87354257
CID 87354257

Frequently Asked Questions

What is the IUPAC name of 5-butyl-6-(methoxymethyl)decan-5-amine?
The IUPAC name of 5-butyl-6-(methoxymethyl)decan-5-amine (CID 87262947) is 5-butyl-6-(methoxymethyl)decan-5-amine.
What is the SMILES notation for 5-butyl-6-(methoxymethyl)decan-5-amine?
The canonical SMILES for 5-butyl-6-(methoxymethyl)decan-5-amine is CCCCC(COC)C(N)(CCCC)CCCC.
What is the InChIKey of 5-butyl-6-(methoxymethyl)decan-5-amine?
The InChIKey is YHVSBNFUUPPWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO/c1-5-8-11-15(14-18-4)16(17,12-9-6-2)13-10-7-3/h15H,5-14,17H2,1-4H3.
What are the key properties of 5-butyl-6-(methoxymethyl)decan-5-amine?
5-butyl-6-(methoxymethyl)decan-5-amine has a molecular weight of 257.46 g/mol, XLogP of 4.52, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-6-(methoxymethyl)decan-5-amine is sourced from PubChem (CID 87262947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).