N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine

C14H27N3 — CID 134321940

IUPACN,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine
SMILESC=C(C1CCN(C)CC1)N1CCC(N(C)C)C1
InChIInChI=1S/C14H27N3/c1-12(13-5-8-16(4)9-6-13)17-10-7-14(11-17)15(2)3/h13-14H,1,5-11H2,2-4H3
InChIKeyWTSPLTFLKMPXTK-UHFFFAOYSA-N
MW237.39 g/mol
LogP1.48
Rot. Bonds3

About N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine

N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine (PubChem CID 134321940) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine
PubChem CID134321940
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC NameN,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine
SMILESC=C(C1CCN(C)CC1)N1CCC(N(C)C)C1
InChIInChI=1S/C14H27N3/c1-12(13-5-8-16(4)9-6-13)17-10-7-14(11-17)15(2)3/h13-14H,1,5-11H2,2-4H3
InChIKeyWTSPLTFLKMPXTK-UHFFFAOYSA-N
XLogP1.48
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine?
The IUPAC name of N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine (CID 134321940) is N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine is C=C(C1CCN(C)CC1)N1CCC(N(C)C)C1.
What is the InChIKey of N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine?
The InChIKey is WTSPLTFLKMPXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-12(13-5-8-16(4)9-6-13)17-10-7-14(11-17)15(2)3/h13-14H,1,5-11H2,2-4H3.
What are the key properties of N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine?
N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine has a molecular weight of 237.39 g/mol, XLogP of 1.48, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[1-(1-methylpiperidin-4-yl)ethenyl]pyrrolidin-3-amine is sourced from PubChem (CID 134321940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).