7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine

C18H35N — CID 174316896

IUPAC7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine
SMILESCC=CNC(C=CCC)CC(C)(C)CCC(C)(C)C
InChIInChI=1S/C18H35N/c1-8-10-11-16(19-14-9-2)15-18(6,7)13-12-17(3,4)5/h9-11,14,16,19H,8,12-13,15H2,1-7H3
InChIKeyWHIAHVZHVCAPRS-UHFFFAOYSA-N
MW265.49 g/mol
LogP5.69
Rot. Bonds8

About 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine

7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine (PubChem CID 174316896) has the molecular formula C18H35N and a molecular weight of 265.49 g/mol. Its IUPAC name is 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine.

Molecular Properties

Compound Name7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine
PubChem CID174316896
Molecular FormulaC18H35N
Molecular Weight265.49 g/mol
Exact Mass265.28
IUPAC Name7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine
SMILESCC=CNC(C=CCC)CC(C)(C)CCC(C)(C)C
InChIInChI=1S/C18H35N/c1-8-10-11-16(19-14-9-2)15-18(6,7)13-12-17(3,4)5/h9-11,14,16,19H,8,12-13,15H2,1-7H3
InChIKeyWHIAHVZHVCAPRS-UHFFFAOYSA-N
XLogP5.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.49
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine?
The IUPAC name of 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine (CID 174316896) is 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine.
What is the SMILES notation for 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine?
The canonical SMILES for 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine is CC=CNC(C=CCC)CC(C)(C)CCC(C)(C)C.
What is the InChIKey of 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine?
The InChIKey is WHIAHVZHVCAPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-8-10-11-16(19-14-9-2)15-18(6,7)13-12-17(3,4)5/h9-11,14,16,19H,8,12-13,15H2,1-7H3.
What are the key properties of 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine?
7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine has a molecular weight of 265.49 g/mol, XLogP of 5.69, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,10,10-tetramethyl-N-prop-1-enylundec-3-en-5-amine is sourced from PubChem (CID 174316896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).