N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine

C11H24N2 — CID 43274680

IUPACN-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
SMILESCCC(C)N(CC)CC1CCCN1
InChIInChI=1S/C11H24N2/c1-4-10(3)13(5-2)9-11-7-6-8-12-11/h10-12H,4-9H2,1-3H3
InChIKeyPNQCRWXEOVXQSG-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.86
Rot. Bonds5

About N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine

N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine (PubChem CID 43274680) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine.

Molecular Properties

Compound NameN-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
PubChem CID43274680
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
SMILESCCC(C)N(CC)CC1CCCN1
InChIInChI=1S/C11H24N2/c1-4-10(3)13(5-2)9-11-7-6-8-12-11/h10-12H,4-9H2,1-3H3
InChIKeyPNQCRWXEOVXQSG-UHFFFAOYSA-N
XLogP1.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 43265935
1-cyclobutyl-N-ethyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 106603623
N-ethyl-N-(pyrrolidin-2-ylmethyl)heptan-2-amine
CID 106603679
N-ethyl-N-(pyrrolidin-2-ylmethyl)nonan-2-amine
CID 106603643
N-ethyl-N-(3-pyrrolidin-2-ylpropyl)butan-2-amine
CID 62479230
N-ethyl-N-(pyrrolidin-2-ylmethyl)but-3-yn-2-amine
CID 106615574
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]butan-2-amine
CID 104870141
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen
CID 164555849
3-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine
CID 106603765
N-ethyl-3-methoxy-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 106603489
N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 106603221
N-(2-methylpropyl)-N-[[(2S)-pyrrolidin-2-yl]methyl]pentan-3-amine
CID 104870302

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine?
The IUPAC name of N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine (CID 43274680) is N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine.
What is the SMILES notation for N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine?
The canonical SMILES for N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine is CCC(C)N(CC)CC1CCCN1.
What is the InChIKey of N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine?
The InChIKey is PNQCRWXEOVXQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-10(3)13(5-2)9-11-7-6-8-12-11/h10-12H,4-9H2,1-3H3.
What are the key properties of N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine?
N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine has a molecular weight of 184.33 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine is sourced from PubChem (CID 43274680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).