1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine

C15H29N3 — CID 115860234

IUPAC1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine
SMILESCCn1ccnc1C(CC(C)CC(C)(C)C)NC
InChIInChI=1S/C15H29N3/c1-7-18-9-8-17-14(18)13(16-6)10-12(2)11-15(3,4)5/h8-9,12-13,16H,7,10-11H2,1-6H3
InChIKeyNDMHKSZTIAYYOI-UHFFFAOYSA-N
MW251.42 g/mol
LogP3.63
Rot. Bonds6

About 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine

1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine (PubChem CID 115860234) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine.

Molecular Properties

Compound Name1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine
PubChem CID115860234
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine
SMILESCCn1ccnc1C(CC(C)CC(C)(C)C)NC
InChIInChI=1S/C15H29N3/c1-7-18-9-8-17-14(18)13(16-6)10-12(2)11-15(3,4)5/h8-9,12-13,16H,7,10-11H2,1-6H3
InChIKeyNDMHKSZTIAYYOI-UHFFFAOYSA-N
XLogP3.63
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N,3-dimethyl-1-(1-propylimidazol-2-yl)butan-1-amine
CID 105148962
[1-(1-ethylimidazol-2-yl)-3-methylpentyl]hydrazine
CID 105308499
3-(1-ethylimidazol-2-yl)-N-methylbutan-2-amine
CID 63199792
N',N'-diethyl-1-(1-ethylimidazol-2-yl)-N-methylpropane-1,3-diamine
CID 79087528
1-(1-ethylimidazol-2-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103215345
1-(1-ethylimidazol-2-yl)-N,2-dimethylpropan-1-amine
CID 63967915
[1-(1-ethylimidazol-2-yl)-3-methylbutyl]hydrazine
CID 105198831
1-(3-ethyltriazol-4-yl)-N,3,5,5-tetramethylhexan-1-amine
CID 114213459
[3,3-dimethyl-1-(1-propylimidazol-2-yl)butyl]hydrazine
CID 105220315
1-(1-ethylimidazol-2-yl)-4-methoxy-3-methyl-N-propylbutan-1-amine
CID 105149787
1-(1-ethylimidazol-2-yl)-N,2-dimethylbutan-1-amine
CID 63968362
1-(1-ethylimidazol-2-yl)-3,5,5-trimethylhexan-1-one
CID 114973012

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine?
The IUPAC name of 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine (CID 115860234) is 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine.
What is the SMILES notation for 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine?
The canonical SMILES for 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine is CCn1ccnc1C(CC(C)CC(C)(C)C)NC.
What is the InChIKey of 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine?
The InChIKey is NDMHKSZTIAYYOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-7-18-9-8-17-14(18)13(16-6)10-12(2)11-15(3,4)5/h8-9,12-13,16H,7,10-11H2,1-6H3.
What are the key properties of 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine?
1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine has a molecular weight of 251.42 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylimidazol-2-yl)-N,3,5,5-tetramethylhexan-1-amine is sourced from PubChem (CID 115860234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).