N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine

C11H22N4 — CID 107206923

IUPACN'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine
SMILESCCn1ccnc1N(C)CCCCCN
InChIInChI=1S/C11H22N4/c1-3-15-10-8-13-11(15)14(2)9-6-4-5-7-12/h8,10H,3-7,9,12H2,1-2H3
InChIKeyGAHVLSDDPDAUKR-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.47
Rot. Bonds7

About N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine

N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine (PubChem CID 107206923) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine.

Molecular Properties

Compound NameN'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine
PubChem CID107206923
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC NameN'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine
SMILESCCn1ccnc1N(C)CCCCCN
InChIInChI=1S/C11H22N4/c1-3-15-10-8-13-11(15)14(2)9-6-4-5-7-12/h8,10H,3-7,9,12H2,1-2H3
InChIKeyGAHVLSDDPDAUKR-UHFFFAOYSA-N
XLogP1.47
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.47
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

N'-(1-ethylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine
CID 79652850
6-(1-ethylimidazol-2-yl)hex-5-yn-1-amine
CID 106208737
3-[(1-ethylimidazol-2-yl)-methylamino]-2-methylpropanethioamide
CID 62138954
3-[5-aminopentyl(methyl)amino]-1-propan-2-ylpyrazin-2-one
CID 107206954
N-(1-chloropropan-2-yl)-1-ethyl-N-methylimidazol-2-amine
CID 104555424
N'-methyl-N'-(1,3-thiazol-2-yl)pentane-1,5-diamine
CID 107207013
N'-methyl-N'-(5-methyl-2-pyridinyl)pentane-1,5-diamine
CID 107206914
3-(2-methoxyimidazol-1-yl)propan-1-amine
CID 82416306
N,N'-dimethyl-N'-[1-(2-methylpropyl)imidazol-2-yl]propane-1,3-diamine
CID 106553235
6-(1-propylimidazol-2-yl)hex-5-yn-1-amine
CID 106208739
3-[bis(2-aminoethyl)amino]-1-ethylpyrazin-2-one
CID 62922421
N-(2-chloroethyl)-1-ethyl-N-propan-2-ylimidazol-2-amine
CID 63392355

Frequently Asked Questions

What is the IUPAC name of N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine?
The IUPAC name of N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine (CID 107206923) is N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine.
What is the SMILES notation for N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine?
The canonical SMILES for N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine is CCn1ccnc1N(C)CCCCCN.
What is the InChIKey of N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine?
The InChIKey is GAHVLSDDPDAUKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-3-15-10-8-13-11(15)14(2)9-6-4-5-7-12/h8,10H,3-7,9,12H2,1-2H3.
What are the key properties of N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine?
N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine has a molecular weight of 210.32 g/mol, XLogP of 1.47, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine is sourced from PubChem (CID 107206923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).