1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine

C19H43N3 — CID 151530221

IUPAC1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine
SMILESCCCCCCCCCC(N(C)CC)(N(C)CC)N(C)CC
InChIInChI=1S/C19H43N3/c1-8-12-13-14-15-16-17-18-19(20(5)9-2,21(6)10-3)22(7)11-4/h8-18H2,1-7H3
InChIKeyPWHWQJVKQGRHHK-UHFFFAOYSA-N
MW313.57 g/mol
LogP4.64
Rot. Bonds14

About 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine

1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine (PubChem CID 151530221) has the molecular formula C19H43N3 and a molecular weight of 313.57 g/mol. Its IUPAC name is 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine.

Molecular Properties

Compound Name1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine
PubChem CID151530221
Molecular FormulaC19H43N3
Molecular Weight313.57 g/mol
Exact Mass313.35
IUPAC Name1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine
SMILESCCCCCCCCCC(N(C)CC)(N(C)CC)N(C)CC
InChIInChI=1S/C19H43N3/c1-8-12-13-14-15-16-17-18-19(20(5)9-2,21(6)10-3)22(7)11-4/h8-18H2,1-7H3
InChIKeyPWHWQJVKQGRHHK-UHFFFAOYSA-N
XLogP4.64
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.57
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine with MolForge

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Related Compounds

1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldodec-11-ene-1,1,1-triamine
CID 172783861
N,N-dimethyl-11-pentylhenicosan-11-amine
CID 175528933
N,N-dimethylmethanamine;tridecane
CID 174432259
CID 172851421
CID 172851421
CID 161216038
CID 161216038
N-ethyl-N,2-dimethylhexan-2-amine
CID 87916195
7-hexyl-N,N-dimethylhexadecan-7-amine;hydrochloride
CID 173284262
6,6-dipentylpentadecane
CID 152650171
8-hexyl-8-pentylhexadecane
CID 521602
9,9-dioctyloctadecane
CID 19690418
19-hexadecyl-19-nonylnonatriacontane
CID 90913331
silane;1,1,1-triiodooctadecane
CID 173345600

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine?
The IUPAC name of 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine (CID 151530221) is 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine.
What is the SMILES notation for 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine?
The canonical SMILES for 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine is CCCCCCCCCC(N(C)CC)(N(C)CC)N(C)CC.
What is the InChIKey of 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine?
The InChIKey is PWHWQJVKQGRHHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H43N3/c1-8-12-13-14-15-16-17-18-19(20(5)9-2,21(6)10-3)22(7)11-4/h8-18H2,1-7H3.
What are the key properties of 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine?
1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine has a molecular weight of 313.57 g/mol, XLogP of 4.64, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N',1-N"-triethyl-1-N,1-N',1-N"-trimethyldecane-1,1,1-triamine is sourced from PubChem (CID 151530221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).