1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine

C9H17N3 — CID 117192906

IUPAC1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine
SMILESCCn1c(CN(C)C)cnc1C
InChIInChI=1S/C9H17N3/c1-5-12-8(2)10-6-9(12)7-11(3)4/h6H,5,7H2,1-4H3
InChIKeyPZZUFOKCHHVQJA-UHFFFAOYSA-N
MW167.26 g/mol
LogP1.27
Rot. Bonds3

About 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine

1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine (PubChem CID 117192906) has the molecular formula C9H17N3 and a molecular weight of 167.26 g/mol. Its IUPAC name is 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine
PubChem CID117192906
Molecular FormulaC9H17N3
Molecular Weight167.26 g/mol
Exact Mass167.14
IUPAC Name1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine
SMILESCCn1c(CN(C)C)cnc1C
InChIInChI=1S/C9H17N3/c1-5-12-8(2)10-6-9(12)7-11(3)4/h6H,5,7H2,1-4H3
InChIKeyPZZUFOKCHHVQJA-UHFFFAOYSA-N
XLogP1.27
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.26
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(chloromethyl)-1-ethyl-2-methylimidazole
CID 130118504
(3-ethyl-2-methylimidazol-4-yl)methanol
CID 117193179
1-ethyl-5-(methoxymethyl)-2-methylimidazole
CID 117193127
2-(3-ethyl-2-methylimidazol-4-yl)acetic acid
CID 55254160
1-ethyl-2-methyl-5-(propan-2-yloxymethyl)imidazole
CID 117193131
1-ethyl-2-methyl-5-(propan-2-ylsulfanylmethyl)imidazole
CID 117193132
1-ethyl-2-methyl-5-(propan-2-ylsulfonylmethyl)imidazole
CID 117192971
1-(3-ethylimidazol-4-yl)-N,N-dimethylmethanamine
CID 117192905
3-(dimethylamino)-1-(3-ethyl-2-methylimidazol-4-yl)prop-2-en-1-one
CID 68688176
1-ethyl-2-methyl-6-oxopyrimidine-5-carbaldehyde
CID 83873436
5-butyl-1-hexadecyl-2-methylimidazole
CID 158644637
ethane;1-(2-ethyl-5-methylpyrazol-3-yl)-N,N-dimethylmethanamine;methanethiol
CID 169135386

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine (CID 117192906) is 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine is CCn1c(CN(C)C)cnc1C.
What is the InChIKey of 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine?
The InChIKey is PZZUFOKCHHVQJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3/c1-5-12-8(2)10-6-9(12)7-11(3)4/h6H,5,7H2,1-4H3.
What are the key properties of 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine?
1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine has a molecular weight of 167.26 g/mol, XLogP of 1.27, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-2-methylimidazol-4-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 117192906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).