N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine

C14H29N3 — CID 81464634

IUPACN,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine
SMILESCC1CN(CCC2CCNCC2)CC1N(C)C
InChIInChI=1S/C14H29N3/c1-12-10-17(11-14(12)16(2)3)9-6-13-4-7-15-8-5-13/h12-15H,4-11H2,1-3H3
InChIKeyNVEKYAWKJLHEMG-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.26
Rot. Bonds4

About N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine

N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine (PubChem CID 81464634) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine
PubChem CID81464634
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine
SMILESCC1CN(CCC2CCNCC2)CC1N(C)C
InChIInChI=1S/C14H29N3/c1-12-10-17(11-14(12)16(2)3)9-6-13-4-7-15-8-5-13/h12-15H,4-11H2,1-3H3
InChIKeyNVEKYAWKJLHEMG-UHFFFAOYSA-N
XLogP1.26
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine?
The IUPAC name of N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine (CID 81464634) is N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine.
What is the SMILES notation for N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine?
The canonical SMILES for N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine is CC1CN(CCC2CCNCC2)CC1N(C)C.
What is the InChIKey of N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine?
The InChIKey is NVEKYAWKJLHEMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-12-10-17(11-14(12)16(2)3)9-6-13-4-7-15-8-5-13/h12-15H,4-11H2,1-3H3.
What are the key properties of N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine?
N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine has a molecular weight of 239.41 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine is sourced from PubChem (CID 81464634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).