(Z)-N,N-dipropylpent-3-en-1-yn-1-amine

C11H19N — CID 23268221

IUPAC(Z)-N,N-dipropylpent-3-en-1-yn-1-amine
SMILESC/C=C\C#CN(CCC)CCC
InChIInChI=1S/C11H19N/c1-4-7-8-11-12(9-5-2)10-6-3/h4,7H,5-6,9-10H2,1-3H3/b7-4-
InChIKeyHWOASDLBTRKVDX-DAXSKMNVSA-N
MW165.28 g/mol
LogP2.65
Rot. Bonds4

About (Z)-N,N-dipropylpent-3-en-1-yn-1-amine

(Z)-N,N-dipropylpent-3-en-1-yn-1-amine (PubChem CID 23268221) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is (Z)-N,N-dipropylpent-3-en-1-yn-1-amine.

Molecular Properties

Compound Name(Z)-N,N-dipropylpent-3-en-1-yn-1-amine
PubChem CID23268221
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name(Z)-N,N-dipropylpent-3-en-1-yn-1-amine
SMILESC/C=C\C#CN(CCC)CCC
InChIInChI=1S/C11H19N/c1-4-7-8-11-12(9-5-2)10-6-3/h4,7H,5-6,9-10H2,1-3H3/b7-4-
InChIKeyHWOASDLBTRKVDX-DAXSKMNVSA-N
XLogP2.65
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-diethylpent-3-en-1-yn-1-amine
CID 58421834
(Z)-oct-2-en-4-yne
CID 5367022
(E)-N,N-di(propan-2-yl)pent-3-en-1-yn-1-amine
CID 134922800
(E)-non-2-en-4-yne
CID 5367387
dec-2-en-4-yne
CID 54142868
N-methyl-N-propylbut-2-en-1-amine
CID 123499797
N-[(Z)-prop-1-enyl]-N-[(E)-prop-1-enyl]propan-1-amine
CID 45087803
hex-2-en-4-yne
CID 518874
(Z)-hex-2-en-4-yne
CID 5367513
(E)-hex-4-en-2-yn-1-ol
CID 10996965
Tripropylamineborane
CID 21315686
N,N-dipropylpropan-1-amine;pentahydrochloride
CID 172789957

Frequently Asked Questions

What is the IUPAC name of (Z)-N,N-dipropylpent-3-en-1-yn-1-amine?
The IUPAC name of (Z)-N,N-dipropylpent-3-en-1-yn-1-amine (CID 23268221) is (Z)-N,N-dipropylpent-3-en-1-yn-1-amine.
What is the SMILES notation for (Z)-N,N-dipropylpent-3-en-1-yn-1-amine?
The canonical SMILES for (Z)-N,N-dipropylpent-3-en-1-yn-1-amine is C/C=C\C#CN(CCC)CCC.
What is the InChIKey of (Z)-N,N-dipropylpent-3-en-1-yn-1-amine?
The InChIKey is HWOASDLBTRKVDX-DAXSKMNVSA-N. The full InChI is InChI=1S/C11H19N/c1-4-7-8-11-12(9-5-2)10-6-3/h4,7H,5-6,9-10H2,1-3H3/b7-4-.
What are the key properties of (Z)-N,N-dipropylpent-3-en-1-yn-1-amine?
(Z)-N,N-dipropylpent-3-en-1-yn-1-amine has a molecular weight of 165.28 g/mol, XLogP of 2.65, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N-dipropylpent-3-en-1-yn-1-amine is sourced from PubChem (CID 23268221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).