[1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine

C17H27N3O — CID 105270131

IUPAC[1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine
SMILESCOc1c(C)cnc(CC(CC2=CCCCC2)NN)c1C
InChIInChI=1S/C17H27N3O/c1-12-11-19-16(13(2)17(12)21-3)10-15(20-18)9-14-7-5-4-6-8-14/h7,11,15,20H,4-6,8-10,18H2,1-3H3
InChIKeyIXAOCXWCTFAOAX-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.97
Rot. Bonds6

About [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine

[1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine (PubChem CID 105270131) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine
PubChem CID105270131
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name[1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine
SMILESCOc1c(C)cnc(CC(CC2=CCCCC2)NN)c1C
InChIInChI=1S/C17H27N3O/c1-12-11-19-16(13(2)17(12)21-3)10-15(20-18)9-14-7-5-4-6-8-14/h7,11,15,20H,4-6,8-10,18H2,1-3H3
InChIKeyIXAOCXWCTFAOAX-UHFFFAOYSA-N
XLogP2.97
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-phenylpropan-2-yl]hydrazine
CID 105195369
[2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105279925
1,1-dimethoxy-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-amine
CID 79493128
[1-(cyclohexen-1-yl)-3-(4-ethylphenyl)propan-2-yl]hydrazine
CID 105269865
N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-methylsulfanylpropan-2-amine
CID 62691956
[1-(2,2-dimethylcyclopentyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine
CID 107193645
[2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-(oxan-4-yl)ethyl]hydrazine
CID 105229756
2-amino-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-1-ol
CID 64574563
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine
CID 62601079
1-(1-methoxycyclopentyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanamine
CID 104610582
[2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-(thiolan-3-yl)ethyl]hydrazine
CID 105297202
2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]butan-1-amine
CID 62505902

Frequently Asked Questions

What is the IUPAC name of [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine (CID 105270131) is [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine is COc1c(C)cnc(CC(CC2=CCCCC2)NN)c1C.
What is the InChIKey of [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine?
The InChIKey is IXAOCXWCTFAOAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-12-11-19-16(13(2)17(12)21-3)10-15(20-18)9-14-7-5-4-6-8-14/h7,11,15,20H,4-6,8-10,18H2,1-3H3.
What are the key properties of [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine?
[1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine has a molecular weight of 289.42 g/mol, XLogP of 2.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclohexen-1-yl)-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105270131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).