azane;N,N-dimethyltetradecanamide;hydrochloride

C16H37ClN2O — CID 174348000

IUPACazane;N,N-dimethyltetradecanamide;hydrochloride
SMILESCCCCCCCCCCCCCC(=O)N(C)C.Cl.N
InChIInChI=1S/C16H33NO.ClH.H3N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16(18)17(2)3;;/h4-15H2,1-3H3;1H;1H3
InChIKeyXTCWSHFMELTMOY-UHFFFAOYSA-N
MW308.94 g/mol
LogP5.36
Rot. Bonds12

About azane;N,N-dimethyltetradecanamide;hydrochloride

azane;N,N-dimethyltetradecanamide;hydrochloride (PubChem CID 174348000) has the molecular formula C16H37ClN2O and a molecular weight of 308.94 g/mol. Its IUPAC name is azane;N,N-dimethyltetradecanamide;hydrochloride.

Molecular Properties

Compound Nameazane;N,N-dimethyltetradecanamide;hydrochloride
PubChem CID174348000
Molecular FormulaC16H37ClN2O
Molecular Weight308.94 g/mol
Exact Mass308.26
IUPAC Nameazane;N,N-dimethyltetradecanamide;hydrochloride
SMILESCCCCCCCCCCCCCC(=O)N(C)C.Cl.N
InChIInChI=1S/C16H33NO.ClH.H3N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16(18)17(2)3;;/h4-15H2,1-3H3;1H;1H3
InChIKeyXTCWSHFMELTMOY-UHFFFAOYSA-N
XLogP5.36
TPSA55.31 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.94
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 173149987
N,N-dimethyldecanamide;N,N-dimethyloctanamide
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N,N-dimethyloctadecanamide;hydrobromide
CID 174406080
N,N-dimethyloctadecanamide;thiourea
CID 174811693
N-decanoyl-N-methyldecanamide
CID 141076390
N,N-dimethylhexanamide;N-methylhexanamide
CID 90794993
N,N-dimethyl-8-(3-octyloxiran-2-yl)octanamide
CID 19889031
N-[4-[[4-(dimethylamino)-4-oxobutyl]amino]-4-oxobutyl]octanamide
CID 86082203
N-hydroxy-N-methyloctadecanamide
CID 19818891
(Z)-N,N-dimethyloctadec-9-enamide;phosphoric acid
CID 174485021
N,N-dimethylbutanamide;hydrochloride
CID 87498306
N-amino-N-hydroxydocosanamide
CID 87686885

Frequently Asked Questions

What is the IUPAC name of azane;N,N-dimethyltetradecanamide;hydrochloride?
The IUPAC name of azane;N,N-dimethyltetradecanamide;hydrochloride (CID 174348000) is azane;N,N-dimethyltetradecanamide;hydrochloride.
What is the SMILES notation for azane;N,N-dimethyltetradecanamide;hydrochloride?
The canonical SMILES for azane;N,N-dimethyltetradecanamide;hydrochloride is CCCCCCCCCCCCCC(=O)N(C)C.Cl.N.
What is the InChIKey of azane;N,N-dimethyltetradecanamide;hydrochloride?
The InChIKey is XTCWSHFMELTMOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO.ClH.H3N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16(18)17(2)3;;/h4-15H2,1-3H3;1H;1H3.
What are the key properties of azane;N,N-dimethyltetradecanamide;hydrochloride?
azane;N,N-dimethyltetradecanamide;hydrochloride has a molecular weight of 308.94 g/mol, XLogP of 5.36, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;N,N-dimethyltetradecanamide;hydrochloride is sourced from PubChem (CID 174348000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).