N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine

C19H37N3 — CID 138632043

IUPACN-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine
SMILESC=C/N=N/N(C=C)C(CCCCCCC)CCCCCCC
InChIInChI=1S/C19H37N3/c1-5-9-11-13-15-17-19(18-16-14-12-10-6-2)22(8-4)21-20-7-3/h7-8,19H,3-6,9-18H2,1-2H3/b21-20+
InChIKeyBFJJGSPIXRWYJG-QZQOTICOSA-N
MW307.53 g/mol
LogP7.03
Rot. Bonds16

About N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine

N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine (PubChem CID 138632043) has the molecular formula C19H37N3 and a molecular weight of 307.53 g/mol. Its IUPAC name is N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine.

Molecular Properties

Compound NameN-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine
PubChem CID138632043
Molecular FormulaC19H37N3
Molecular Weight307.53 g/mol
Exact Mass307.30
IUPAC NameN-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine
SMILESC=C/N=N/N(C=C)C(CCCCCCC)CCCCCCC
InChIInChI=1S/C19H37N3/c1-5-9-11-13-15-17-19(18-16-14-12-10-6-2)22(8-4)21-20-7-3/h7-8,19H,3-6,9-18H2,1-2H3/b21-20+
InChIKeyBFJJGSPIXRWYJG-QZQOTICOSA-N
XLogP7.03
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.53
LogP ≤ 57.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis(ethenyl)-N-pentadecan-8-ylmethanimidamide
CID 146212188
3-ethenylnon-1-ene
CID 123641938
N-methyl-N-prop-2-enylhenicosan-11-amine
CID 174654754
(10R)-N,N-dimethylheptacosan-10-amine
CID 134549801
N,N-dimethyltetracontan-19-amine
CID 45382230
N,N-dimethylicosan-5-amine
CID 19862397
N,N-dimethylpentadecan-8-amine;hydrobromide
CID 173437553
N,N-dimethylicosan-7-amine;hydrobromide
CID 173410689
10-ethenylnonadecane
CID 57244946
ethane;9-ethenylheptadecane;octane
CID 168985515
N-chloro-N-methylhenicosan-11-amine
CID 141096758
N,N-dimethylnonadec-1-en-3-amine
CID 174330581

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine?
The IUPAC name of N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine (CID 138632043) is N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine.
What is the SMILES notation for N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine?
The canonical SMILES for N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine is C=C/N=N/N(C=C)C(CCCCCCC)CCCCCCC.
What is the InChIKey of N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine?
The InChIKey is BFJJGSPIXRWYJG-QZQOTICOSA-N. The full InChI is InChI=1S/C19H37N3/c1-5-9-11-13-15-17-19(18-16-14-12-10-6-2)22(8-4)21-20-7-3/h7-8,19H,3-6,9-18H2,1-2H3/b21-20+.
What are the key properties of N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine?
N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine has a molecular weight of 307.53 g/mol, XLogP of 7.03, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-(ethenyldiazenyl)pentadecan-8-amine is sourced from PubChem (CID 138632043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).