1-butyl-4-methylimidazolidine

C8H18N2 — CID 145156152

IUPAC1-butyl-4-methylimidazolidine
SMILESCCCCN1CNC(C)C1
InChIInChI=1S/C8H18N2/c1-3-4-5-10-6-8(2)9-7-10/h8-9H,3-7H2,1-2H3
InChIKeyXAHCSFPYGWUXAF-UHFFFAOYSA-N
MW142.25 g/mol
LogP1.04
Rot. Bonds3

About 1-butyl-4-methylimidazolidine

1-butyl-4-methylimidazolidine (PubChem CID 145156152) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 1-butyl-4-methylimidazolidine.

Molecular Properties

Compound Name1-butyl-4-methylimidazolidine
PubChem CID145156152
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name1-butyl-4-methylimidazolidine
SMILESCCCCN1CNC(C)C1
InChIInChI=1S/C8H18N2/c1-3-4-5-10-6-8(2)9-7-10/h8-9H,3-7H2,1-2H3
InChIKeyXAHCSFPYGWUXAF-UHFFFAOYSA-N
XLogP1.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dimethyl-1-pentylpiperazine
CID 63862612
4-butyl-1,2,6-trimethylpiperazine
CID 126991132
2,2,5-trimethyl-1-pentylpiperazine
CID 64845904
1-butyl-2-cyclopropyl-2,5-dimethylpiperazine
CID 64844568
1-butan-2-yl-3,5-dimethylpiperazine;1-butyl-3,5-dimethylpiperazine
CID 68570113
N,N-dimethyl-3-[(3R)-3-methylpiperazin-1-yl]propan-1-amine
CID 95436399
3-methyl-1-(3-propoxypropyl)-1,4-diazepane
CID 82947779
1-[3-(3-methylpiperazin-1-yl)propyl]-3-octadecylurea
CID 139652311
4,10-dibutyl-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradecane
CID 162493113
2-butan-2-yl-1-butyl-5-methylpiperazine
CID 64846296
1-(3-fluoropropyl)-3-methyl-1,4-diazepane
CID 81113476
(3aS,6aS)-5-butyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole
CID 64850440

Frequently Asked Questions

What is the IUPAC name of 1-butyl-4-methylimidazolidine?
The IUPAC name of 1-butyl-4-methylimidazolidine (CID 145156152) is 1-butyl-4-methylimidazolidine.
What is the SMILES notation for 1-butyl-4-methylimidazolidine?
The canonical SMILES for 1-butyl-4-methylimidazolidine is CCCCN1CNC(C)C1.
What is the InChIKey of 1-butyl-4-methylimidazolidine?
The InChIKey is XAHCSFPYGWUXAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-3-4-5-10-6-8(2)9-7-10/h8-9H,3-7H2,1-2H3.
What are the key properties of 1-butyl-4-methylimidazolidine?
1-butyl-4-methylimidazolidine has a molecular weight of 142.25 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-4-methylimidazolidine is sourced from PubChem (CID 145156152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).