(3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine

C10H17N — CID 143165077

IUPAC(3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine
SMILESC=C/C=C\C(=C)N(C)CCC
InChIInChI=1S/C10H17N/c1-5-7-8-10(3)11(4)9-6-2/h5,7-8H,1,3,6,9H2,2,4H3/b8-7-
InChIKeyZQAXUUCVBDAHSS-FPLPWBNLSA-N
MW151.25 g/mol
LogP2.58
Rot. Bonds5

About (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine

(3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine (PubChem CID 143165077) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine.

Molecular Properties

Compound Name(3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine
PubChem CID143165077
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine
SMILESC=C/C=C\C(=C)N(C)CCC
InChIInChI=1S/C10H17N/c1-5-7-8-10(3)11(4)9-6-2/h5,7-8H,1,3,6,9H2,2,4H3/b8-7-
InChIKeyZQAXUUCVBDAHSS-FPLPWBNLSA-N
XLogP2.58
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine?
The IUPAC name of (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine (CID 143165077) is (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine.
What is the SMILES notation for (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine?
The canonical SMILES for (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine is C=C/C=C\C(=C)N(C)CCC.
What is the InChIKey of (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine?
The InChIKey is ZQAXUUCVBDAHSS-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H17N/c1-5-7-8-10(3)11(4)9-6-2/h5,7-8H,1,3,6,9H2,2,4H3/b8-7-.
What are the key properties of (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine?
(3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine has a molecular weight of 151.25 g/mol, XLogP of 2.58, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N-methyl-N-propylhexa-1,3,5-trien-2-amine is sourced from PubChem (CID 143165077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).