[1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine

C16H26N4O — CID 105272000

IUPAC[1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine
SMILESCCn1c(CC(NN)C(OC)C(C)C)nc2ccccc21
InChIInChI=1S/C16H26N4O/c1-5-20-14-9-7-6-8-12(14)18-15(20)10-13(19-17)16(21-4)11(2)3/h6-9,11,13,16,19H,5,10,17H2,1-4H3
InChIKeyMCAWVEJYTUDODU-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.10
Rot. Bonds7

About [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine

[1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine (PubChem CID 105272000) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine
PubChem CID105272000
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name[1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine
SMILESCCn1c(CC(NN)C(OC)C(C)C)nc2ccccc21
InChIInChI=1S/C16H26N4O/c1-5-20-14-9-7-6-8-12(14)18-15(20)10-13(19-17)16(21-4)11(2)3/h6-9,11,13,16,19H,5,10,17H2,1-4H3
InChIKeyMCAWVEJYTUDODU-UHFFFAOYSA-N
XLogP2.10
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[3-methoxy-1-(1-propylbenzimidazol-2-yl)pentan-2-yl]hydrazine
CID 105270881
1-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79753828
N-ethyl-3-methoxy-4-methyl-1-(1-methylbenzimidazol-2-yl)pentan-2-amine
CID 116720444
[1-(1-ethylbenzimidazol-2-yl)-3-propan-2-yloxypropan-2-yl]hydrazine
CID 105321101
1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4,4-dimethylpentan-2-amine
CID 116724283
[1-butan-2-ylsulfanyl-3-(1-ethylbenzimidazol-2-yl)propan-2-yl]hydrazine
CID 105227069
4-(1-ethylbenzimidazol-2-yl)-2,3-dimethyl-N-propan-2-ylbutan-1-amine
CID 81011531
N-ethyl-3-(1-ethylbenzimidazol-2-yl)-1,1-difluoropropan-2-amine
CID 103516859
N-ethyl-1-(1-ethylbenzimidazol-2-yl)-3-methylhexan-2-amine
CID 105007782
(1-ethylbenzimidazol-2-yl)methylhydrazine
CID 53275104
3-ethyl-1-(1-ethylbenzimidazol-2-yl)-3-methoxypentan-2-ol
CID 116752874
1-(1-ethylbenzimidazol-2-yl)-4-methoxybutan-2-ol
CID 79754353

Frequently Asked Questions

What is the IUPAC name of [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine?
The IUPAC name of [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine (CID 105272000) is [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine is CCn1c(CC(NN)C(OC)C(C)C)nc2ccccc21.
What is the InChIKey of [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine?
The InChIKey is MCAWVEJYTUDODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-5-20-14-9-7-6-8-12(14)18-15(20)10-13(19-17)16(21-4)11(2)3/h6-9,11,13,16,19H,5,10,17H2,1-4H3.
What are the key properties of [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine?
[1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine has a molecular weight of 290.41 g/mol, XLogP of 2.10, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine is sourced from PubChem (CID 105272000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).