N,N-dipropylpent-3-en-2-amine;hydrochloride

C11H24ClN — CID 155653024

IUPACN,N-dipropylpent-3-en-2-amine;hydrochloride
SMILESCC=CC(C)N(CCC)CCC.Cl
InChIInChI=1S/C11H23N.ClH/c1-5-8-11(4)12(9-6-2)10-7-3;/h5,8,11H,6-7,9-10H2,1-4H3;1H
InChIKeyHFXFWPPBUGKIEG-UHFFFAOYSA-N
MW205.77 g/mol
LogP3.49
Rot. Bonds6

About N,N-dipropylpent-3-en-2-amine;hydrochloride

N,N-dipropylpent-3-en-2-amine;hydrochloride (PubChem CID 155653024) has the molecular formula C11H24ClN and a molecular weight of 205.77 g/mol. Its IUPAC name is N,N-dipropylpent-3-en-2-amine;hydrochloride.

Molecular Properties

Compound NameN,N-dipropylpent-3-en-2-amine;hydrochloride
PubChem CID155653024
Molecular FormulaC11H24ClN
Molecular Weight205.77 g/mol
Exact Mass205.16
IUPAC NameN,N-dipropylpent-3-en-2-amine;hydrochloride
SMILESCC=CC(C)N(CCC)CCC.Cl
InChIInChI=1S/C11H23N.ClH/c1-5-8-11(4)12(9-6-2)10-7-3;/h5,8,11H,6-7,9-10H2,1-4H3;1H
InChIKeyHFXFWPPBUGKIEG-UHFFFAOYSA-N
XLogP3.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.77
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-N,N-dipropylpent-3-en-2-amine
CID 121218071
N-pent-3-en-2-yl-N-pentylpentan-1-amine;hydrochloride
CID 155653033
1-N,1-N,1-N',1-N'-tetrapropylethane-1,1-diamine
CID 141222296
(E)-N,N-dimethylpent-3-en-2-amine;hydrochloride
CID 155225928
N,N-dipropylbutan-2-amine
CID 524229
N,N-dipropylbutan-2-amine;ethane;propane
CID 143577846
(E)-4-methylpent-2-ene;propane
CID 142019888
(Z)-4-methylhept-2-ene
CID 5352649
(E)-4-methylicos-2-ene
CID 166512402
1-N-propan-2-yl-1-N-propylbutane-1,3-diamine
CID 43269493
(Z)-4-chlorohept-2-ene
CID 88578806
[butan-2-yl(propyl)amino]methanethiol
CID 142982154

Frequently Asked Questions

What is the IUPAC name of N,N-dipropylpent-3-en-2-amine;hydrochloride?
The IUPAC name of N,N-dipropylpent-3-en-2-amine;hydrochloride (CID 155653024) is N,N-dipropylpent-3-en-2-amine;hydrochloride.
What is the SMILES notation for N,N-dipropylpent-3-en-2-amine;hydrochloride?
The canonical SMILES for N,N-dipropylpent-3-en-2-amine;hydrochloride is CC=CC(C)N(CCC)CCC.Cl.
What is the InChIKey of N,N-dipropylpent-3-en-2-amine;hydrochloride?
The InChIKey is HFXFWPPBUGKIEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N.ClH/c1-5-8-11(4)12(9-6-2)10-7-3;/h5,8,11H,6-7,9-10H2,1-4H3;1H.
What are the key properties of N,N-dipropylpent-3-en-2-amine;hydrochloride?
N,N-dipropylpent-3-en-2-amine;hydrochloride has a molecular weight of 205.77 g/mol, XLogP of 3.49, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropylpent-3-en-2-amine;hydrochloride is sourced from PubChem (CID 155653024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).