(Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine

C11H23N — CID 59059950

IUPAC(Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine
SMILESCC(C)C/C=C\CN(C)C(C)C
InChIInChI=1S/C11H23N/c1-10(2)8-6-7-9-12(5)11(3)4/h6-7,10-11H,8-9H2,1-5H3/b7-6-
InChIKeyLQQSCQLWMZITED-SREVYHEPSA-N
MW169.31 g/mol
LogP2.93
Rot. Bonds5

About (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine

(Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine (PubChem CID 59059950) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine.

Molecular Properties

Compound Name(Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine
PubChem CID59059950
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name(Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine
SMILESCC(C)C/C=C\CN(C)C(C)C
InChIInChI=1S/C11H23N/c1-10(2)8-6-7-9-12(5)11(3)4/h6-7,10-11H,8-9H2,1-5H3/b7-6-
InChIKeyLQQSCQLWMZITED-SREVYHEPSA-N
XLogP2.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.93
H-Bond Donors ≤ 50
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 (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine?
The IUPAC name of (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine (CID 59059950) is (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine.
What is the SMILES notation for (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine?
The canonical SMILES for (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine is CC(C)C/C=C\CN(C)C(C)C.
What is the InChIKey of (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine?
The InChIKey is LQQSCQLWMZITED-SREVYHEPSA-N. The full InChI is InChI=1S/C11H23N/c1-10(2)8-6-7-9-12(5)11(3)4/h6-7,10-11H,8-9H2,1-5H3/b7-6-.
What are the key properties of (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine?
(Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.93, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,5-dimethyl-N-propan-2-ylhex-2-en-1-amine is sourced from PubChem (CID 59059950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).