N,N-dibutylundec-10-en-1-amine

C19H39N — CID 118629062

IUPACN,N-dibutylundec-10-en-1-amine
SMILESC=CCCCCCCCCCN(CCCC)CCCC
InChIInChI=1S/C19H39N/c1-4-7-10-11-12-13-14-15-16-19-20(17-8-5-2)18-9-6-3/h4H,1,5-19H2,2-3H3
InChIKeyKQXGTTJBFSVZOM-UHFFFAOYSA-N
MW281.53 g/mol
LogP6.20
Rot. Bonds16

About N,N-dibutylundec-10-en-1-amine

N,N-dibutylundec-10-en-1-amine (PubChem CID 118629062) has the molecular formula C19H39N and a molecular weight of 281.53 g/mol. Its IUPAC name is N,N-dibutylundec-10-en-1-amine.

Molecular Properties

Compound NameN,N-dibutylundec-10-en-1-amine
PubChem CID118629062
Molecular FormulaC19H39N
Molecular Weight281.53 g/mol
Exact Mass281.31
IUPAC NameN,N-dibutylundec-10-en-1-amine
SMILESC=CCCCCCCCCCN(CCCC)CCCC
InChIInChI=1S/C19H39N/c1-4-7-10-11-12-13-14-15-16-19-20(17-8-5-2)18-9-6-3/h4H,1,5-19H2,2-3H3
InChIKeyKQXGTTJBFSVZOM-UHFFFAOYSA-N
XLogP6.20
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.53
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutylundec-10-en-1-amine?
The IUPAC name of N,N-dibutylundec-10-en-1-amine (CID 118629062) is N,N-dibutylundec-10-en-1-amine.
What is the SMILES notation for N,N-dibutylundec-10-en-1-amine?
The canonical SMILES for N,N-dibutylundec-10-en-1-amine is C=CCCCCCCCCCN(CCCC)CCCC.
What is the InChIKey of N,N-dibutylundec-10-en-1-amine?
The InChIKey is KQXGTTJBFSVZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39N/c1-4-7-10-11-12-13-14-15-16-19-20(17-8-5-2)18-9-6-3/h4H,1,5-19H2,2-3H3.
What are the key properties of N,N-dibutylundec-10-en-1-amine?
N,N-dibutylundec-10-en-1-amine has a molecular weight of 281.53 g/mol, XLogP of 6.20, 16 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutylundec-10-en-1-amine is sourced from PubChem (CID 118629062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).