N,N-dipropylbut-1-en-1-amine

C10H21N — CID 575133

IUPACN,N-dipropylbut-1-en-1-amine
SMILESCCC=CN(CCC)CCC
InChIInChI=1S/C10H21N/c1-4-7-10-11(8-5-2)9-6-3/h7,10H,4-6,8-9H2,1-3H3
InChIKeyWWOOWPONZPEAJF-UHFFFAOYSA-N
MW155.28 g/mol
LogP3.03
Rot. Bonds6

About N,N-dipropylbut-1-en-1-amine

N,N-dipropylbut-1-en-1-amine (PubChem CID 575133) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is N,N-dipropylbut-1-en-1-amine.

Molecular Properties

Compound NameN,N-dipropylbut-1-en-1-amine
PubChem CID575133
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC NameN,N-dipropylbut-1-en-1-amine
SMILESCCC=CN(CCC)CCC
InChIInChI=1S/C10H21N/c1-4-7-10-11(8-5-2)9-6-3/h7,10H,4-6,8-9H2,1-3H3
InChIKeyWWOOWPONZPEAJF-UHFFFAOYSA-N
XLogP3.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dipropylbut-1-en-1-amine?
The IUPAC name of N,N-dipropylbut-1-en-1-amine (CID 575133) is N,N-dipropylbut-1-en-1-amine.
What is the SMILES notation for N,N-dipropylbut-1-en-1-amine?
The canonical SMILES for N,N-dipropylbut-1-en-1-amine is CCC=CN(CCC)CCC.
What is the InChIKey of N,N-dipropylbut-1-en-1-amine?
The InChIKey is WWOOWPONZPEAJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-4-7-10-11(8-5-2)9-6-3/h7,10H,4-6,8-9H2,1-3H3.
What are the key properties of N,N-dipropylbut-1-en-1-amine?
N,N-dipropylbut-1-en-1-amine has a molecular weight of 155.28 g/mol, XLogP of 3.03, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropylbut-1-en-1-amine is sourced from PubChem (CID 575133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).