N,N-dimethylpent-4-en-1-amine;ethane

C9H21N — CID 155570199

IUPACN,N-dimethylpent-4-en-1-amine;ethane
SMILESC=CCCCN(C)C.CC
InChIInChI=1S/C7H15N.C2H6/c1-4-5-6-7-8(2)3;1-2/h4H,1,5-7H2,2-3H3;1-2H3
InChIKeyYTOHZENSAWTQKE-UHFFFAOYSA-N
MW143.27 g/mol
LogP2.54
Rot. Bonds4

About N,N-dimethylpent-4-en-1-amine;ethane

N,N-dimethylpent-4-en-1-amine;ethane (PubChem CID 155570199) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is N,N-dimethylpent-4-en-1-amine;ethane.

Molecular Properties

Compound NameN,N-dimethylpent-4-en-1-amine;ethane
PubChem CID155570199
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC NameN,N-dimethylpent-4-en-1-amine;ethane
SMILESC=CCCCN(C)C.CC
InChIInChI=1S/C7H15N.C2H6/c1-4-5-6-7-8(2)3;1-2/h4H,1,5-7H2,2-3H3;1-2H3
InChIKeyYTOHZENSAWTQKE-UHFFFAOYSA-N
XLogP2.54
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.27
LogP ≤ 52.54
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-dimethyl-3-trideca-1,12-dien-7-yloxypropan-1-amine;ethane
CID 171629250
carbanide;N,N-dimethylbut-3-en-1-amine;hexa-1,5-diene;tris(platinum(4+));N,N,N',N'-tetramethylethane-1,2-diamine
CID 161382891
2-(dimethylamino)ethyl-dimethyl-pent-4-enylazanium
CID 155589580
ethane;N-methyl-N-pent-4-enylacetamide
CID 143214157
N-methyl-N-propylpent-4-en-1-amine
CID 91551262
buta-1,3-diene;N,N,N',N'-tetramethylethane-1,2-diamine
CID 160608362
N-ethyl-N-pent-4-enylpentan-1-amine
CID 154960176
N-methyl-N-pent-4-enylmethanesulfonamide
CID 115640453
4-(dimethylamino)butanethial
CID 54408635
N-iodo-N-methyloct-7-en-1-amine
CID 170105765
N-methyl-N-pent-4-enylpropanamide
CID 115640317
N,N-bis(pent-4-enyl)methanesulfonamide
CID 155624324

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpent-4-en-1-amine;ethane?
The IUPAC name of N,N-dimethylpent-4-en-1-amine;ethane (CID 155570199) is N,N-dimethylpent-4-en-1-amine;ethane.
What is the SMILES notation for N,N-dimethylpent-4-en-1-amine;ethane?
The canonical SMILES for N,N-dimethylpent-4-en-1-amine;ethane is C=CCCCN(C)C.CC.
What is the InChIKey of N,N-dimethylpent-4-en-1-amine;ethane?
The InChIKey is YTOHZENSAWTQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.C2H6/c1-4-5-6-7-8(2)3;1-2/h4H,1,5-7H2,2-3H3;1-2H3.
What are the key properties of N,N-dimethylpent-4-en-1-amine;ethane?
N,N-dimethylpent-4-en-1-amine;ethane has a molecular weight of 143.27 g/mol, XLogP of 2.54, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpent-4-en-1-amine;ethane is sourced from PubChem (CID 155570199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).