4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine

C12H29N3O — CID 105240456

IUPAC4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine
SMILESCCC(C)(C(NN)C(C)CCOC)N(C)C
InChIInChI=1S/C12H29N3O/c1-7-12(3,15(4)5)11(14-13)10(2)8-9-16-6/h10-11,14H,7-9,13H2,1-6H3
InChIKeyKEVAQCPWTIVICQ-UHFFFAOYSA-N
MW231.38 g/mol
LogP1.22
Rot. Bonds8

About 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine

4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine (PubChem CID 105240456) has the molecular formula C12H29N3O and a molecular weight of 231.38 g/mol. Its IUPAC name is 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine.

Molecular Properties

Compound Name4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine
PubChem CID105240456
Molecular FormulaC12H29N3O
Molecular Weight231.38 g/mol
Exact Mass231.23
IUPAC Name4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine
SMILESCCC(C)(C(NN)C(C)CCOC)N(C)C
InChIInChI=1S/C12H29N3O/c1-7-12(3,15(4)5)11(14-13)10(2)8-9-16-6/h10-11,14H,7-9,13H2,1-6H3
InChIKeyKEVAQCPWTIVICQ-UHFFFAOYSA-N
XLogP1.22
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

7-methoxy-3-N,3-N,3-trimethylheptane-3,4-diamine
CID 114856218
1,5-dimethoxy-3,5-dimethylheptan-4-ol
CID 116752012
(1-methoxy-4-methylhexan-3-yl)hydrazine
CID 105206462
(5-ethyl-1-methoxy-3-methylheptan-4-yl)hydrazine
CID 105337856
3,3,5-trimethyloctan-4-ylhydrazine
CID 107896017
5-ethoxy-1-methoxy-3,5-dimethylheptan-4-ol
CID 116752304
1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
CID 105240669
[4-methoxy-2-methyl-1-(1-methylcyclopentyl)butyl]hydrazine
CID 105337921
5-methoxy-N,N,2,3-tetramethylpentan-1-amine
CID 144662876
N-ethyl-1,6-dimethoxy-3,6-dimethylheptan-4-amine
CID 103029407
[4-methoxy-2-methyl-1-(2,2,3,3-tetramethylcyclopropyl)butyl]hydrazine
CID 105338060
4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine
CID 105240612

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine?
The IUPAC name of 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine (CID 105240456) is 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine.
What is the SMILES notation for 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine?
The canonical SMILES for 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine is CCC(C)(C(NN)C(C)CCOC)N(C)C.
What is the InChIKey of 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine?
The InChIKey is KEVAQCPWTIVICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29N3O/c1-7-12(3,15(4)5)11(14-13)10(2)8-9-16-6/h10-11,14H,7-9,13H2,1-6H3.
What are the key properties of 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine?
4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine has a molecular weight of 231.38 g/mol, XLogP of 1.22, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-7-methoxy-N,N,3,5-tetramethylheptan-3-amine is sourced from PubChem (CID 105240456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).