2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine

C9H17N3O — CID 62348774

IUPAC2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine
SMILESCCn1ccnc1OC(C)CNC
InChIInChI=1S/C9H17N3O/c1-4-12-6-5-11-9(12)13-8(2)7-10-3/h5-6,8,10H,4,7H2,1-3H3
InChIKeyZWXKSTGRCYMPQC-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.89
Rot. Bonds5

About 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine

2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine (PubChem CID 62348774) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine
PubChem CID62348774
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine
SMILESCCn1ccnc1OC(C)CNC
InChIInChI=1S/C9H17N3O/c1-4-12-6-5-11-9(12)13-8(2)7-10-3/h5-6,8,10H,4,7H2,1-3H3
InChIKeyZWXKSTGRCYMPQC-UHFFFAOYSA-N
XLogP0.89
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1-ethylimidazol-2-yl)-N,2-dimethylpropan-1-amine
CID 64666437
1-ethyl-3-[[2-methyl-3-(methylamino)propyl]amino]pyrazin-2-one
CID 115303205
3-(1-ethylimidazol-2-yl)-N-methylbutan-2-amine
CID 63199792
1-ethyl-2-(4-propan-2-yloxyphenyl)imidazole
CID 110540542
1-(1-ethylimidazol-2-yl)-N,2-dimethylbutan-1-amine
CID 63968362
1-(1-ethylimidazol-2-yl)-N,2-dimethylpropan-1-amine
CID 63967915
1-ethyl-2-prop-1-en-2-yloxyimidazole
CID 174361377
N-ethyl-1-(1-ethylimidazol-2-yl)-2-methylpropan-1-amine
CID 63967917
2-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)oxy-N-methylpropan-1-amine
CID 104733456
1-ethyl-2-[(1R)-1-iodoethyl]imidazole
CID 97177373
1-(1-ethylimidazol-2-yl)ethanamine
CID 63970415
2-(1-bromoethyl)-1-ethylimidazole
CID 71635251

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine?
The IUPAC name of 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine (CID 62348774) is 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine is CCn1ccnc1OC(C)CNC.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine?
The InChIKey is ZWXKSTGRCYMPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-4-12-6-5-11-9(12)13-8(2)7-10-3/h5-6,8,10H,4,7H2,1-3H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine?
2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine has a molecular weight of 183.25 g/mol, XLogP of 0.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)oxy-N-methylpropan-1-amine is sourced from PubChem (CID 62348774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).