N,N-dimethyloctadecanamide;hydrobromide

C20H42BrNO — CID 174406080

IUPACN,N-dimethyloctadecanamide;hydrobromide
SMILESBr.CCCCCCCCCCCCCCCCCC(=O)N(C)C
InChIInChI=1S/C20H41NO.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(2)3;/h4-19H2,1-3H3;1H
InChIKeyFNQKDNSLNBDGJV-UHFFFAOYSA-N
MW392.47 g/mol
LogP6.91
Rot. Bonds16

About N,N-dimethyloctadecanamide;hydrobromide

N,N-dimethyloctadecanamide;hydrobromide (PubChem CID 174406080) has the molecular formula C20H42BrNO and a molecular weight of 392.47 g/mol. Its IUPAC name is N,N-dimethyloctadecanamide;hydrobromide.

Molecular Properties

Compound NameN,N-dimethyloctadecanamide;hydrobromide
PubChem CID174406080
Molecular FormulaC20H42BrNO
Molecular Weight392.47 g/mol
Exact Mass391.24
IUPAC NameN,N-dimethyloctadecanamide;hydrobromide
SMILESBr.CCCCCCCCCCCCCCCCCC(=O)N(C)C
InChIInChI=1S/C20H41NO.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(2)3;/h4-19H2,1-3H3;1H
InChIKeyFNQKDNSLNBDGJV-UHFFFAOYSA-N
XLogP6.91
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.47
LogP ≤ 56.91
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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Related Compounds

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N,N-dimethyloctadecanamide;thiourea
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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
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12-hydroxy-N,N-dimethyldodecanamide
CID 14819908
11-hydroxy-N,N-dimethylundecanamide
CID 14819907

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyloctadecanamide;hydrobromide?
The IUPAC name of N,N-dimethyloctadecanamide;hydrobromide (CID 174406080) is N,N-dimethyloctadecanamide;hydrobromide.
What is the SMILES notation for N,N-dimethyloctadecanamide;hydrobromide?
The canonical SMILES for N,N-dimethyloctadecanamide;hydrobromide is Br.CCCCCCCCCCCCCCCCCC(=O)N(C)C.
What is the InChIKey of N,N-dimethyloctadecanamide;hydrobromide?
The InChIKey is FNQKDNSLNBDGJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41NO.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(2)3;/h4-19H2,1-3H3;1H.
What are the key properties of N,N-dimethyloctadecanamide;hydrobromide?
N,N-dimethyloctadecanamide;hydrobromide has a molecular weight of 392.47 g/mol, XLogP of 6.91, 16 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyloctadecanamide;hydrobromide is sourced from PubChem (CID 174406080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).