5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine

C15H29N3O — CID 79761113

IUPAC5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine
SMILESCCCNC(CCCOC)Cc1nccn1CCC
InChIInChI=1S/C15H29N3O/c1-4-8-16-14(7-6-12-19-3)13-15-17-9-11-18(15)10-5-2/h9,11,14,16H,4-8,10,12-13H2,1-3H3
InChIKeyJEPLBPUIBOQRDT-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.63
Rot. Bonds11

About 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine

5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine (PubChem CID 79761113) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine.

Molecular Properties

Compound Name5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine
PubChem CID79761113
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine
SMILESCCCNC(CCCOC)Cc1nccn1CCC
InChIInChI=1S/C15H29N3O/c1-4-8-16-14(7-6-12-19-3)13-15-17-9-11-18(15)10-5-2/h9,11,14,16H,4-8,10,12-13H2,1-3H3
InChIKeyJEPLBPUIBOQRDT-UHFFFAOYSA-N
XLogP2.63
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-methoxy-1-(1-methylimidazol-2-yl)-N-propylpentan-2-amine
CID 79760856
N-propyl-1-(1-propylimidazol-2-yl)heptan-2-amine
CID 105012472
5-methoxy-1-(1-propylimidazol-2-yl)pentan-2-amine
CID 79760450
4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine
CID 105012343
1-(1-ethylimidazol-2-yl)-N-propylnonan-2-amine
CID 105009255
1,1-dimethoxy-N-propyl-3-(1-propylimidazol-2-yl)propan-2-amine
CID 79760658
1-methylsulfonyl-N-propyl-3-(1-propylimidazol-2-yl)propan-2-amine
CID 105012195
N-ethyl-4-propoxy-1-(1-propylimidazol-2-yl)butan-2-amine
CID 105167661
4,5,5-trimethyl-N-propyl-1-(1-propylimidazol-2-yl)hexan-2-amine
CID 105012491
N-propyl-1-(1-propylimidazol-2-yl)-3-(2,2,2-trifluoroethoxy)propan-2-amine
CID 103215840
N-propyl-1-(1-propylimidazol-2-yl)-3-pyridin-2-ylpropan-2-amine
CID 79752625
N-ethyl-1-(1-ethylimidazol-2-yl)-4-methoxybutan-2-amine
CID 79751583

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine?
The IUPAC name of 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine (CID 79761113) is 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine.
What is the SMILES notation for 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine?
The canonical SMILES for 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine is CCCNC(CCCOC)Cc1nccn1CCC.
What is the InChIKey of 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine?
The InChIKey is JEPLBPUIBOQRDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-4-8-16-14(7-6-12-19-3)13-15-17-9-11-18(15)10-5-2/h9,11,14,16H,4-8,10,12-13H2,1-3H3.
What are the key properties of 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine?
5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine has a molecular weight of 267.42 g/mol, XLogP of 2.63, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine is sourced from PubChem (CID 79761113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).