1-[(1-ethylimidazol-2-yl)methyl]diazinane

C10H18N4 — CID 131219616

IUPAC1-[(1-ethylimidazol-2-yl)methyl]diazinane
SMILESCCn1ccnc1CN1CCCCN1
InChIInChI=1S/C10H18N4/c1-2-13-8-6-11-10(13)9-14-7-4-3-5-12-14/h6,8,12H,2-5,7,9H2,1H3
InChIKeyXIQYRSSOTZZJNN-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.00
Rot. Bonds3

About 1-[(1-ethylimidazol-2-yl)methyl]diazinane

1-[(1-ethylimidazol-2-yl)methyl]diazinane (PubChem CID 131219616) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-[(1-ethylimidazol-2-yl)methyl]diazinane.

Molecular Properties

Compound Name1-[(1-ethylimidazol-2-yl)methyl]diazinane
PubChem CID131219616
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-[(1-ethylimidazol-2-yl)methyl]diazinane
SMILESCCn1ccnc1CN1CCCCN1
InChIInChI=1S/C10H18N4/c1-2-13-8-6-11-10(13)9-14-7-4-3-5-12-14/h6,8,12H,2-5,7,9H2,1H3
InChIKeyXIQYRSSOTZZJNN-UHFFFAOYSA-N
XLogP1.00
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(1-ethylimidazol-2-yl)methyl]diazinane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-1-[(1-ethylimidazol-2-yl)methyl]-2-methylpiperazine
CID 82761036
1-ethyl-2-[(2-methylimidazol-1-yl)methyl]imidazole
CID 62406588
[1-[(1-ethylimidazol-2-yl)methyl]-4-(pyrrolidin-1-ylmethyl)piperidin-4-yl]methanol
CID 91791648
1-[(1-ethylimidazol-2-yl)methyl]piperazine-2-carbonitrile
CID 79085370
(4aS,8aR)-1-[(1-ethylimidazol-2-yl)methyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
CID 100901496
1-[(1-ethylimidazol-2-yl)methyl]-N-methylpiperidin-3-amine
CID 62736422
(3R)-1-[(1-ethylimidazol-2-yl)methyl]piperidin-3-amine
CID 94576709
(3S)-1-[(1-ethylimidazol-2-yl)methyl]piperidin-3-ol
CID 107226188
1-cyclobutyl-2-(1-ethylimidazol-2-yl)ethanone
CID 79744561
1-ethyl-2-(iodomethyl)imidazole
CID 64786618
1-[(1-ethylimidazol-2-yl)methyl]azocane-2-carboxylic acid
CID 114239952
[1-[(1-ethylimidazol-2-yl)methyl]piperidin-3-yl]methanol
CID 62735695

Frequently Asked Questions

What is the IUPAC name of 1-[(1-ethylimidazol-2-yl)methyl]diazinane?
The IUPAC name of 1-[(1-ethylimidazol-2-yl)methyl]diazinane (CID 131219616) is 1-[(1-ethylimidazol-2-yl)methyl]diazinane.
What is the SMILES notation for 1-[(1-ethylimidazol-2-yl)methyl]diazinane?
The canonical SMILES for 1-[(1-ethylimidazol-2-yl)methyl]diazinane is CCn1ccnc1CN1CCCCN1.
What is the InChIKey of 1-[(1-ethylimidazol-2-yl)methyl]diazinane?
The InChIKey is XIQYRSSOTZZJNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-2-13-8-6-11-10(13)9-14-7-4-3-5-12-14/h6,8,12H,2-5,7,9H2,1H3.
What are the key properties of 1-[(1-ethylimidazol-2-yl)methyl]diazinane?
1-[(1-ethylimidazol-2-yl)methyl]diazinane has a molecular weight of 194.28 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-ethylimidazol-2-yl)methyl]diazinane is sourced from PubChem (CID 131219616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).