3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine

C11H21N3 — CID 115580390

IUPAC3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine
SMILESCCC(CC)C(N)Cc1nccn1C
InChIInChI=1S/C11H21N3/c1-4-9(5-2)10(12)8-11-13-6-7-14(11)3/h6-7,9-10H,4-5,8,12H2,1-3H3
InChIKeyGXNQMMRZUPPCRM-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.73
Rot. Bonds5

About 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine

3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine (PubChem CID 115580390) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine.

Molecular Properties

Compound Name3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine
PubChem CID115580390
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine
SMILESCCC(CC)C(N)Cc1nccn1C
InChIInChI=1S/C11H21N3/c1-4-9(5-2)10(12)8-11-13-6-7-14(11)3/h6-7,9-10H,4-5,8,12H2,1-3H3
InChIKeyGXNQMMRZUPPCRM-UHFFFAOYSA-N
XLogP1.73
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-3-methyl-1-(1-methylimidazol-2-yl)butan-2-amine
CID 79762264
N,3,3-trimethyl-1-(1-methylimidazol-2-yl)butan-2-amine
CID 63198283
ethyl 2-amino-3-(1-methylimidazol-2-yl)propanoate
CID 62961673
1-(4-tert-butylphenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 115580384
2-ethyl-1-methylimidazole;ethyl(trihydroxy)phosphanium
CID 174757497
4-(1-methylimidazol-2-yl)butan-1-amine
CID 79762041
[4-methoxy-4-methyl-1-(1-methylimidazol-2-yl)pentan-2-yl]hydrazine
CID 103025406
2-(2-bromopentyl)-1-methylimidazole
CID 63203989
[4,4-dimethyl-1-(1-methylimidazol-2-yl)pentan-2-yl]hydrazine
CID 105220503
1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
CID 67392091
3-methoxy-3-methyl-1-(1-methylimidazol-2-yl)-N-propylpentan-2-amine
CID 116758319
methanamine;1-methyl-2-propylimidazole
CID 164902083

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine?
The IUPAC name of 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine (CID 115580390) is 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine.
What is the SMILES notation for 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine?
The canonical SMILES for 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine is CCC(CC)C(N)Cc1nccn1C.
What is the InChIKey of 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine?
The InChIKey is GXNQMMRZUPPCRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-4-9(5-2)10(12)8-11-13-6-7-14(11)3/h6-7,9-10H,4-5,8,12H2,1-3H3.
What are the key properties of 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine?
3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine has a molecular weight of 195.31 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine is sourced from PubChem (CID 115580390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).