3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine

C14H31NO — CID 20714781

IUPAC3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine
SMILESCCCN(CCC)CCC(CC)CCOC
InChIInChI=1S/C14H31NO/c1-5-10-15(11-6-2)12-8-14(7-3)9-13-16-4/h14H,5-13H2,1-4H3
InChIKeyWDJBGIQHCXPYDM-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.56
Rot. Bonds11

About 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine

3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine (PubChem CID 20714781) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine.

Molecular Properties

Compound Name3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine
PubChem CID20714781
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC Name3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine
SMILESCCCN(CCC)CCC(CC)CCOC
InChIInChI=1S/C14H31NO/c1-5-10-15(11-6-2)12-8-14(7-3)9-13-16-4/h14H,5-13H2,1-4H3
InChIKeyWDJBGIQHCXPYDM-UHFFFAOYSA-N
XLogP3.56
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-Methoxyethyl)-1-propylpiperidine
CID 134579822
5-Dimethylamino-3-methyl-pentanol
CID 11147796
1-(Fluoromethyl)-4-(2-methoxyethyl)piperidine
CID 154684316
5-(Diethylamino)-3-methylpentan-1-ol
CID 12040636
5-(Dibutylamino)-3-methylpentan-1-ol
CID 12040637
N,N-dibutyl-4-methyloxan-2-amine
CID 12040644
5-[(5-Hydroxy-3-methylpentyl)-methylamino]-3-methylpentan-1-ol
CID 12040646
N,N,4-trimethyloxan-2-amine
CID 12349967
N,N-diethyl-5-methoxypentan-1-amine
CID 13112460
5-Methoxy-N,N-dimethylpentan-1-amine
CID 13115259
3-(Methoxymethyl)-1-methylpiperidine
CID 18682727
3-ethyl-5-methoxy-N,N-dimethylpentan-1-amine
CID 20714780

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine?
The IUPAC name of 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine (CID 20714781) is 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine.
What is the SMILES notation for 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine?
The canonical SMILES for 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine is CCCN(CCC)CCC(CC)CCOC.
What is the InChIKey of 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine?
The InChIKey is WDJBGIQHCXPYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-5-10-15(11-6-2)12-8-14(7-3)9-13-16-4/h14H,5-13H2,1-4H3.
What are the key properties of 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine?
3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine has a molecular weight of 229.41 g/mol, XLogP of 3.56, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-methoxy-N,N-dipropylpentan-1-amine is sourced from PubChem (CID 20714781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).