N-methyl-N-propylpent-4-en-1-amine

C9H19N — CID 91551262

IUPACN-methyl-N-propylpent-4-en-1-amine
SMILESC=CCCCN(C)CCC
InChIInChI=1S/C9H19N/c1-4-6-7-9-10(3)8-5-2/h4H,1,5-9H2,2-3H3
InChIKeyZQFIZAYXQBEXQU-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.29
Rot. Bonds6

About N-methyl-N-propylpent-4-en-1-amine

N-methyl-N-propylpent-4-en-1-amine (PubChem CID 91551262) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-methyl-N-propylpent-4-en-1-amine.

Molecular Properties

Compound NameN-methyl-N-propylpent-4-en-1-amine
PubChem CID91551262
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-methyl-N-propylpent-4-en-1-amine
SMILESC=CCCCN(C)CCC
InChIInChI=1S/C9H19N/c1-4-6-7-9-10(3)8-5-2/h4H,1,5-9H2,2-3H3
InChIKeyZQFIZAYXQBEXQU-UHFFFAOYSA-N
XLogP2.29
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethylpent-4-en-1-amine;ethane
CID 155570199
but-1-ene;ethane;N-heptyl-N-methylheptan-1-amine
CID 172567126
N,N'-dimethyl-N'-[2-[methyl(propyl)amino]ethyl]-N-propylethane-1,2-diamine
CID 162082787
N,N,N'-trimethyl-N'-[3-[methyl(propyl)amino]propyl]propane-1,3-diamine
CID 20621536
N-methyl-N-propyldecan-1-amine
CID 13122225
N'-but-3-enyl-N-ethyl-N,N'-dimethylethane-1,2-diamine
CID 142953317
N-ethyl-N-pent-4-enylpentan-1-amine
CID 154960176
hex-1-ene;zinc
CID 174554611
N-methyl-N-pent-4-enylpropanamide
CID 115640317
but-1-ene;tetrakis(hex-1-ene)
CID 22000755
octadeca-1,17-diene;tetradec-1-ene
CID 173070986
non-1-ene
CID 141296734

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propylpent-4-en-1-amine?
The IUPAC name of N-methyl-N-propylpent-4-en-1-amine (CID 91551262) is N-methyl-N-propylpent-4-en-1-amine.
What is the SMILES notation for N-methyl-N-propylpent-4-en-1-amine?
The canonical SMILES for N-methyl-N-propylpent-4-en-1-amine is C=CCCCN(C)CCC.
What is the InChIKey of N-methyl-N-propylpent-4-en-1-amine?
The InChIKey is ZQFIZAYXQBEXQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-4-6-7-9-10(3)8-5-2/h4H,1,5-9H2,2-3H3.
What are the key properties of N-methyl-N-propylpent-4-en-1-amine?
N-methyl-N-propylpent-4-en-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.29, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propylpent-4-en-1-amine is sourced from PubChem (CID 91551262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).