N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine

C11H24N2 — CID 18713592

IUPACN-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine
SMILESCCN(CC)CC1CN(C)CC1C
InChIInChI=1S/C11H24N2/c1-5-13(6-2)9-11-8-12(4)7-10(11)3/h10-11H,5-9H2,1-4H3
InChIKeyMASLBKADCLGUHI-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.53
Rot. Bonds4

About N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine

N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine (PubChem CID 18713592) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine.

Molecular Properties

Compound NameN-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine
PubChem CID18713592
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine
SMILESCCN(CC)CC1CN(C)CC1C
InChIInChI=1S/C11H24N2/c1-5-13(6-2)9-11-8-12(4)7-10(11)3/h10-11H,5-9H2,1-4H3
InChIKeyMASLBKADCLGUHI-UHFFFAOYSA-N
XLogP1.53
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine?
The IUPAC name of N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine (CID 18713592) is N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine.
What is the SMILES notation for N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine?
The canonical SMILES for N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine is CCN(CC)CC1CN(C)CC1C.
What is the InChIKey of N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine?
The InChIKey is MASLBKADCLGUHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-5-13(6-2)9-11-8-12(4)7-10(11)3/h10-11H,5-9H2,1-4H3.
What are the key properties of N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine?
N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine has a molecular weight of 184.33 g/mol, XLogP of 1.53, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,4-dimethylpyrrolidin-3-yl)methyl]-N-ethylethanamine is sourced from PubChem (CID 18713592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).