N-ethyl-2-methyl-N-propylbut-3-en-1-amine

C10H21N — CID 143574283

IUPACN-ethyl-2-methyl-N-propylbut-3-en-1-amine
SMILESC=CC(C)CN(CC)CCC
InChIInChI=1S/C10H21N/c1-5-8-11(7-3)9-10(4)6-2/h6,10H,2,5,7-9H2,1,3-4H3
InChIKeyMTZMDKXFWMDIBL-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.54
Rot. Bonds6

About N-ethyl-2-methyl-N-propylbut-3-en-1-amine

N-ethyl-2-methyl-N-propylbut-3-en-1-amine (PubChem CID 143574283) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is N-ethyl-2-methyl-N-propylbut-3-en-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-N-propylbut-3-en-1-amine
PubChem CID143574283
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC NameN-ethyl-2-methyl-N-propylbut-3-en-1-amine
SMILESC=CC(C)CN(CC)CCC
InChIInChI=1S/C10H21N/c1-5-8-11(7-3)9-10(4)6-2/h6,10H,2,5,7-9H2,1,3-4H3
InChIKeyMTZMDKXFWMDIBL-UHFFFAOYSA-N
XLogP2.54
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 ≤ 52.54
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

N,N-diethylpropan-1-amine;2-methylpropane
CID 143334042
3-[ethyl(propyl)amino]-2-methylpropanoic acid
CID 43538770
3-chloro-N-ethyl-2-methyl-N-propylbut-3-en-1-amine
CID 123222105
N-ethyl-3-methyl-N-propylbutan-1-amine
CID 89085287
N-ethyl-N'-(2-methylpropyl)-N,N'-dipropylethane-1,2-diamine
CID 123205995
butane;3,6-dimethylocta-1,7-diene;ethane;propane
CID 144723339
N,N-diethylpropan-1-amine;methane
CID 144711865
N,N-diethylethanamine;N,N-dipropylpropan-1-amine
CID 22257187
N-ethyl-2-methyl-N,N'-dipropylpropane-1,3-diamine
CID 62420843
2-methyl-N,N-dipropylhex-5-en-1-amine
CID 143366711
N-ethyl-N-propylbutan-1-amine;methane;prop-1-ene
CID 178172448
N-ethyl-N,N',N'-tripropylethane-1,2-diamine
CID 88655813

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-N-propylbut-3-en-1-amine?
The IUPAC name of N-ethyl-2-methyl-N-propylbut-3-en-1-amine (CID 143574283) is N-ethyl-2-methyl-N-propylbut-3-en-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-N-propylbut-3-en-1-amine?
The canonical SMILES for N-ethyl-2-methyl-N-propylbut-3-en-1-amine is C=CC(C)CN(CC)CCC.
What is the InChIKey of N-ethyl-2-methyl-N-propylbut-3-en-1-amine?
The InChIKey is MTZMDKXFWMDIBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-5-8-11(7-3)9-10(4)6-2/h6,10H,2,5,7-9H2,1,3-4H3.
What are the key properties of N-ethyl-2-methyl-N-propylbut-3-en-1-amine?
N-ethyl-2-methyl-N-propylbut-3-en-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.54, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-N-propylbut-3-en-1-amine is sourced from PubChem (CID 143574283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).