N,N-bis(prop-2-enyl)tetradecan-1-amine

C20H39N — CID 10424485

IUPACN,N-bis(prop-2-enyl)tetradecan-1-amine
SMILESC=CCN(CC=C)CCCCCCCCCCCCCC
InChIInChI=1S/C20H39N/c1-4-7-8-9-10-11-12-13-14-15-16-17-20-21(18-5-2)19-6-3/h5-6H,2-4,7-20H2,1H3
InChIKeyHNRPWNCIFZSWPG-UHFFFAOYSA-N
MW293.54 g/mol
LogP6.36
Rot. Bonds17

About N,N-bis(prop-2-enyl)tetradecan-1-amine

N,N-bis(prop-2-enyl)tetradecan-1-amine (PubChem CID 10424485) has the molecular formula C20H39N and a molecular weight of 293.54 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)tetradecan-1-amine.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)tetradecan-1-amine
PubChem CID10424485
Molecular FormulaC20H39N
Molecular Weight293.54 g/mol
Exact Mass293.31
IUPAC NameN,N-bis(prop-2-enyl)tetradecan-1-amine
SMILESC=CCN(CC=C)CCCCCCCCCCCCCC
InChIInChI=1S/C20H39N/c1-4-7-8-9-10-11-12-13-14-15-16-17-20-21(18-5-2)19-6-3/h5-6H,2-4,7-20H2,1H3
InChIKeyHNRPWNCIFZSWPG-UHFFFAOYSA-N
XLogP6.36
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds17
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.54
LogP ≤ 56.36
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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Related Compounds

Allyldimethyldodecylammonium bromide
CID 10520722
Dodecyl-methyl-bis(prop-2-enyl)azanium bromide
CID 10642264
12-[Diethyl(prop-2-enyl)azaniumyl]dodecyl-diethyl-prop-2-enylazanium dibromide
CID 10769098
Bis[2-[dimethyl(undecyl)azaniumyl]ethyl]-methyl-prop-2-enylazanium tribromide
CID 118721047
Bis[3-[dodecyl(dimethyl)azaniumyl]propyl]-methyl-prop-2-enylazanium tribromide
CID 118721058
dimethyl-[(2E,4E,6E)-octa-2,4,6-trienyl]-tridecylazanium iodide
CID 122181924
dimethyl-[(2E,4E,6E)-octa-2,4,6-trienyl]-tetradecylazanium iodide
CID 122181926
hexadecyl-dimethyl-[(2E,4E,6E)-octa-2,4,6-trienyl]azanium iodide
CID 122181928
Hexadecylamine, N,N-di(allyl)-
CID 10448774
Octadecen-1-amine, N,N-dimethyl-
CID 119807
Bis[2-[decyl(dimethyl)azaniumyl]ethyl]-methyl-prop-2-enylazanium tribromide
CID 118721045
Bis[2-[dodecyl(dimethyl)azaniumyl]ethyl]-methyl-prop-2-enylazanium tribromide
CID 118721049

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)tetradecan-1-amine?
The IUPAC name of N,N-bis(prop-2-enyl)tetradecan-1-amine (CID 10424485) is N,N-bis(prop-2-enyl)tetradecan-1-amine.
What is the SMILES notation for N,N-bis(prop-2-enyl)tetradecan-1-amine?
The canonical SMILES for N,N-bis(prop-2-enyl)tetradecan-1-amine is C=CCN(CC=C)CCCCCCCCCCCCCC.
What is the InChIKey of N,N-bis(prop-2-enyl)tetradecan-1-amine?
The InChIKey is HNRPWNCIFZSWPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H39N/c1-4-7-8-9-10-11-12-13-14-15-16-17-20-21(18-5-2)19-6-3/h5-6H,2-4,7-20H2,1H3.
What are the key properties of N,N-bis(prop-2-enyl)tetradecan-1-amine?
N,N-bis(prop-2-enyl)tetradecan-1-amine has a molecular weight of 293.54 g/mol, XLogP of 6.36, 17 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)tetradecan-1-amine is sourced from PubChem (CID 10424485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).