2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine

C16H33N3 — CID 115145658

IUPAC2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine
SMILESCN1CCC(C(C)(C)CNC2CCNC(C)(C)C2)C1
InChIInChI=1S/C16H33N3/c1-15(2,13-7-9-19(5)11-13)12-17-14-6-8-18-16(3,4)10-14/h13-14,17-18H,6-12H2,1-5H3
InChIKeyGJJHAZRPADEMLW-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.08
Rot. Bonds4

About 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine

2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine (PubChem CID 115145658) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine
PubChem CID115145658
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC Name2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine
SMILESCN1CCC(C(C)(C)CNC2CCNC(C)(C)C2)C1
InChIInChI=1S/C16H33N3/c1-15(2,13-7-9-19(5)11-13)12-17-14-6-8-18-16(3,4)10-14/h13-14,17-18H,6-12H2,1-5H3
InChIKeyGJJHAZRPADEMLW-UHFFFAOYSA-N
XLogP2.08
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine?
The IUPAC name of 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine (CID 115145658) is 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine.
What is the SMILES notation for 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine?
The canonical SMILES for 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine is CN1CCC(C(C)(C)CNC2CCNC(C)(C)C2)C1.
What is the InChIKey of 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine?
The InChIKey is GJJHAZRPADEMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-15(2,13-7-9-19(5)11-13)12-17-14-6-8-18-16(3,4)10-14/h13-14,17-18H,6-12H2,1-5H3.
What are the key properties of 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine?
2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine has a molecular weight of 267.46 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine is sourced from PubChem (CID 115145658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).