N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine

C13H29N3 — CID 105239271

IUPACN,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine
SMILESC=C(C)CCC(NN)C(C)(C)N(CC)CC
InChIInChI=1S/C13H29N3/c1-7-16(8-2)13(5,6)12(15-14)10-9-11(3)4/h12,15H,3,7-10,14H2,1-2,4-6H3
InChIKeyQXWRAKFJGNZXNM-UHFFFAOYSA-N
MW227.40 g/mol
LogP2.30
Rot. Bonds8

About N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine

N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine (PubChem CID 105239271) has the molecular formula C13H29N3 and a molecular weight of 227.40 g/mol. Its IUPAC name is N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine.

Molecular Properties

Compound NameN,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine
PubChem CID105239271
Molecular FormulaC13H29N3
Molecular Weight227.40 g/mol
Exact Mass227.24
IUPAC NameN,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine
SMILESC=C(C)CCC(NN)C(C)(C)N(CC)CC
InChIInChI=1S/C13H29N3/c1-7-16(8-2)13(5,6)12(15-14)10-9-11(3)4/h12,15H,3,7-10,14H2,1-2,4-6H3
InChIKeyQXWRAKFJGNZXNM-UHFFFAOYSA-N
XLogP2.30
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.40
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

2-N,2-N-diethyl-2-methyl-5-methylideneheptane-2,3-diamine
CID 79052870
3-N-ethyl-2-N,2-N,2-trimethyl-5-methylideneheptane-2,3-diamine
CID 79052919
2-N,2-N,3-N,2-tetramethyl-5-methylideneheptane-2,3-diamine
CID 79053202
2-N,2-N,2-trimethyl-5-methylidene-3-N-propylheptane-2,3-diamine
CID 79053637
2-N,2-N,2-trimethyl-5-methylideneheptane-2,3-diamine
CID 79053801
2-N,2-N-diethyl-3-N,2-dimethyl-5-methylideneheptane-2,3-diamine
CID 79056408
2-N,2-N,3-N-triethyl-2-methyl-5-methylideneheptane-2,3-diamine
CID 79056587
3-N,3-N-diethyl-3-methyl-6-methylideneoctane-3,4-diamine
CID 79069215
3-N,3-N-diethyl-3,6-dimethylhept-6-ene-3,4-diamine
CID 79185470
2-N,2-N-diethyl-2,5-dimethylhex-5-ene-2,3-diamine
CID 79185961
3-N,3-N,3-triethyl-6-methylhept-6-ene-3,4-diamine
CID 79186671
3-hydrazinyl-N,N,2-trimethyloct-7-en-2-amine
CID 105238851

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine?
The IUPAC name of N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine (CID 105239271) is N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine.
What is the SMILES notation for N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine?
The canonical SMILES for N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine is C=C(C)CCC(NN)C(C)(C)N(CC)CC.
What is the InChIKey of N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine?
The InChIKey is QXWRAKFJGNZXNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3/c1-7-16(8-2)13(5,6)12(15-14)10-9-11(3)4/h12,15H,3,7-10,14H2,1-2,4-6H3.
What are the key properties of N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine?
N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine has a molecular weight of 227.40 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-hydrazinyl-2,6-dimethylhept-6-en-2-amine is sourced from PubChem (CID 105239271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).