N,N-bis(ethenyl)dodecan-1-amine

C16H31N — CID 14389660

IUPACN,N-bis(ethenyl)dodecan-1-amine
SMILESC=CN(C=C)CCCCCCCCCCCC
InChIInChI=1S/C16H31N/c1-4-7-8-9-10-11-12-13-14-15-16-17(5-2)6-3/h5-6H,2-4,7-16H2,1H3
InChIKeyAOCYPNRLYKNNRI-UHFFFAOYSA-N
MW237.43 g/mol
LogP5.50
Rot. Bonds13

About N,N-bis(ethenyl)dodecan-1-amine

N,N-bis(ethenyl)dodecan-1-amine (PubChem CID 14389660) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is N,N-bis(ethenyl)dodecan-1-amine.

Molecular Properties

Compound NameN,N-bis(ethenyl)dodecan-1-amine
PubChem CID14389660
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC NameN,N-bis(ethenyl)dodecan-1-amine
SMILESC=CN(C=C)CCCCCCCCCCCC
InChIInChI=1S/C16H31N/c1-4-7-8-9-10-11-12-13-14-15-16-17(5-2)6-3/h5-6H,2-4,7-16H2,1H3
InChIKeyAOCYPNRLYKNNRI-UHFFFAOYSA-N
XLogP5.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500237.43
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(ethenyl)dodecan-1-amine?
The IUPAC name of N,N-bis(ethenyl)dodecan-1-amine (CID 14389660) is N,N-bis(ethenyl)dodecan-1-amine.
What is the SMILES notation for N,N-bis(ethenyl)dodecan-1-amine?
The canonical SMILES for N,N-bis(ethenyl)dodecan-1-amine is C=CN(C=C)CCCCCCCCCCCC.
What is the InChIKey of N,N-bis(ethenyl)dodecan-1-amine?
The InChIKey is AOCYPNRLYKNNRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-4-7-8-9-10-11-12-13-14-15-16-17(5-2)6-3/h5-6H,2-4,7-16H2,1H3.
What are the key properties of N,N-bis(ethenyl)dodecan-1-amine?
N,N-bis(ethenyl)dodecan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 5.50, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(ethenyl)dodecan-1-amine is sourced from PubChem (CID 14389660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).