N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine

C11H24N2 — CID 142940994

IUPACN-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine
SMILESCCC(CN1CCCC1)N(C)CC
InChIInChI=1S/C11H24N2/c1-4-11(12(3)5-2)10-13-8-6-7-9-13/h11H,4-10H2,1-3H3
InChIKeyWLAKMRZOZQHCFN-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.81
Rot. Bonds5

About N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine

N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine (PubChem CID 142940994) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine
PubChem CID142940994
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine
SMILESCCC(CN1CCCC1)N(C)CC
InChIInChI=1S/C11H24N2/c1-4-11(12(3)5-2)10-13-8-6-7-9-13/h11H,4-10H2,1-3H3
InChIKeyWLAKMRZOZQHCFN-UHFFFAOYSA-N
XLogP1.81
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(azonan-1-yl)butan-2-ol
CID 130671766
1,6-diethyl-1,6-diazecane
CID 172611513
N-ethyl-N,3-dimethyl-4-piperidin-1-ylbutan-1-amine
CID 171788339
N-methyl-1-pyrrolidin-1-ylbutan-2-amine
CID 62039052
2-N-methyl-1-N-(2-methylpropyl)-2-N-(2-pyrrolidin-1-ylethyl)butane-1,2-diamine
CID 63209169
1-ethylpiperidine
CID 13007
1-ethylpyrrolidine;hydrofluoride
CID 163271504
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
CID 159983719
azane;1-(2-methylpropyl)pyrrolidine
CID 122583370
ethane;1-ethylpiperidine
CID 90845344
1-ethylpiperidine;methane
CID 162133943
1-(2-chloropropyl)pyrrolidine
CID 3020097

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine?
The IUPAC name of N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine (CID 142940994) is N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine.
What is the SMILES notation for N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine?
The canonical SMILES for N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine is CCC(CN1CCCC1)N(C)CC.
What is the InChIKey of N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine?
The InChIKey is WLAKMRZOZQHCFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-11(12(3)5-2)10-13-8-6-7-9-13/h11H,4-10H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine?
N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine has a molecular weight of 184.33 g/mol, XLogP of 1.81, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-1-pyrrolidin-1-ylbutan-2-amine is sourced from PubChem (CID 142940994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).