N,N,3-triethyldodecan-3-amine

C18H39N — CID 150961559

IUPACN,N,3-triethyldodecan-3-amine
SMILESCCCCCCCCCC(CC)(CC)N(CC)CC
InChIInChI=1S/C18H39N/c1-6-11-12-13-14-15-16-17-18(7-2,8-3)19(9-4)10-5/h6-17H2,1-5H3
InChIKeyLMEYWUVROUDSKJ-UHFFFAOYSA-N
MW269.52 g/mol
LogP6.03
Rot. Bonds13

About N,N,3-triethyldodecan-3-amine

N,N,3-triethyldodecan-3-amine (PubChem CID 150961559) has the molecular formula C18H39N and a molecular weight of 269.52 g/mol. Its IUPAC name is N,N,3-triethyldodecan-3-amine.

Molecular Properties

Compound NameN,N,3-triethyldodecan-3-amine
PubChem CID150961559
Molecular FormulaC18H39N
Molecular Weight269.52 g/mol
Exact Mass269.31
IUPAC NameN,N,3-triethyldodecan-3-amine
SMILESCCCCCCCCCC(CC)(CC)N(CC)CC
InChIInChI=1S/C18H39N/c1-6-11-12-13-14-15-16-17-18(7-2,8-3)19(9-4)10-5/h6-17H2,1-5H3
InChIKeyLMEYWUVROUDSKJ-UHFFFAOYSA-N
XLogP6.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500269.52
LogP ≤ 56.03
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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CID 155011902
N,N-dimethyl-11-pentylhenicosan-11-amine
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CID 173284262
calcium;hydride;octane
CID 173403164
N,N-dimethyl-6-pentylundecan-6-amine
CID 170848103
2-N,2-diethyl-2-N-pentylbutane-1,2-diamine
CID 62008795
2-(dimethylamino)heptadecan-2-ol
CID 57269512
tetradecane-6,6-dithiol
CID 54417735
hexacosane-11,11-dithiol
CID 91479109
3-[ethenyl-(2-methylhydrazinyl)amino]-3-ethyltetradecane
CID 155688240
19-hexadecyl-19-nonylnonatriacontane
CID 90913331
9,9-dioctyloctadecane
CID 19690418

Frequently Asked Questions

What is the IUPAC name of N,N,3-triethyldodecan-3-amine?
The IUPAC name of N,N,3-triethyldodecan-3-amine (CID 150961559) is N,N,3-triethyldodecan-3-amine.
What is the SMILES notation for N,N,3-triethyldodecan-3-amine?
The canonical SMILES for N,N,3-triethyldodecan-3-amine is CCCCCCCCCC(CC)(CC)N(CC)CC.
What is the InChIKey of N,N,3-triethyldodecan-3-amine?
The InChIKey is LMEYWUVROUDSKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H39N/c1-6-11-12-13-14-15-16-17-18(7-2,8-3)19(9-4)10-5/h6-17H2,1-5H3.
What are the key properties of N,N,3-triethyldodecan-3-amine?
N,N,3-triethyldodecan-3-amine has a molecular weight of 269.52 g/mol, XLogP of 6.03, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-triethyldodecan-3-amine is sourced from PubChem (CID 150961559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).