N,N,2,5-tetraethylhept-6-en-1-amine

C15H31N — CID 170847767

IUPACN,N,2,5-tetraethylhept-6-en-1-amine
SMILESC=CC(CC)CCC(CC)CN(CC)CC
InChIInChI=1S/C15H31N/c1-6-14(7-2)11-12-15(8-3)13-16(9-4)10-5/h6,14-15H,1,7-13H2,2-5H3
InChIKeyKNLKFXGMKQKPFN-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.35
Rot. Bonds10

About N,N,2,5-tetraethylhept-6-en-1-amine

N,N,2,5-tetraethylhept-6-en-1-amine (PubChem CID 170847767) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is N,N,2,5-tetraethylhept-6-en-1-amine.

Molecular Properties

Compound NameN,N,2,5-tetraethylhept-6-en-1-amine
PubChem CID170847767
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC NameN,N,2,5-tetraethylhept-6-en-1-amine
SMILESC=CC(CC)CCC(CC)CN(CC)CC
InChIInChI=1S/C15H31N/c1-6-14(7-2)11-12-15(8-3)13-16(9-4)10-5/h6,14-15H,1,7-13H2,2-5H3
InChIKeyKNLKFXGMKQKPFN-UHFFFAOYSA-N
XLogP4.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-Ethylhexylamine, N,N-di(allyl)-
CID 19751114
N,N-diethyl-3-[(1R)-4-methylcyclohex-3-en-1-yl]butan-1-amine
CID 11117679
1,2-dilinoleyl-N,N-dimethyl-3-aminopropane
CID 139600217
n,n-Diethylundec-10-en-1-amine
CID 237835
N,N-diethyl-2-methylhept-6-en-1-amine
CID 17824958
N-ethyl-N-(4-fluoro-4-methylpentyl)-9-methyl-8-methylideneoctadecan-1-amine
CID 145405414
3-Allylazacyclotridecane
CID 145865699
N,N,4-trimethylpentadec-1-en-6-amine
CID 170848016
N,N-diethyl-4-methylhept-6-en-1-amine
CID 170848093
N,N-diethyl-5-methyloct-7-en-1-amine
CID 170848094
N,N-diethyl-6-methylnon-8-en-1-amine
CID 170848095
N,N,3-triethyl-2-methylpent-4-en-1-amine
CID 170848096

Frequently Asked Questions

What is the IUPAC name of N,N,2,5-tetraethylhept-6-en-1-amine?
The IUPAC name of N,N,2,5-tetraethylhept-6-en-1-amine (CID 170847767) is N,N,2,5-tetraethylhept-6-en-1-amine.
What is the SMILES notation for N,N,2,5-tetraethylhept-6-en-1-amine?
The canonical SMILES for N,N,2,5-tetraethylhept-6-en-1-amine is C=CC(CC)CCC(CC)CN(CC)CC.
What is the InChIKey of N,N,2,5-tetraethylhept-6-en-1-amine?
The InChIKey is KNLKFXGMKQKPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-6-14(7-2)11-12-15(8-3)13-16(9-4)10-5/h6,14-15H,1,7-13H2,2-5H3.
What are the key properties of N,N,2,5-tetraethylhept-6-en-1-amine?
N,N,2,5-tetraethylhept-6-en-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.35, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,5-tetraethylhept-6-en-1-amine is sourced from PubChem (CID 170847767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).