N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine

C16H33N3 — CID 81464515

IUPACN,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine
SMILESCCCC1(CN2CC(C)C(N(C)C)C2)CCCNC1
InChIInChI=1S/C16H33N3/c1-5-7-16(8-6-9-17-12-16)13-19-10-14(2)15(11-19)18(3)4/h14-15,17H,5-13H2,1-4H3
InChIKeyCHWIUCRNHCODMU-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.04
Rot. Bonds5

About N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine

N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine (PubChem CID 81464515) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine
PubChem CID81464515
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC NameN,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine
SMILESCCCC1(CN2CC(C)C(N(C)C)C2)CCCNC1
InChIInChI=1S/C16H33N3/c1-5-7-16(8-6-9-17-12-16)13-19-10-14(2)15(11-19)18(3)4/h14-15,17H,5-13H2,1-4H3
InChIKeyCHWIUCRNHCODMU-UHFFFAOYSA-N
XLogP2.04
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.04
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-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine?
The IUPAC name of N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine (CID 81464515) is N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine.
What is the SMILES notation for N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine?
The canonical SMILES for N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine is CCCC1(CN2CC(C)C(N(C)C)C2)CCCNC1.
What is the InChIKey of N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine?
The InChIKey is CHWIUCRNHCODMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-5-7-16(8-6-9-17-12-16)13-19-10-14(2)15(11-19)18(3)4/h14-15,17H,5-13H2,1-4H3.
What are the key properties of N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine?
N,N,4-trimethyl-1-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine has a molecular weight of 267.46 g/mol, XLogP of 2.04, 5 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-[(3-propylpiperidin-3-yl)methyl]pyrrolidin-3-amine is sourced from PubChem (CID 81464515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).