2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine

C15H31N3 — CID 115209785

IUPAC2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine
SMILESCN1CCC(C(C)(C)CNCC2CCCNC2)C1
InChIInChI=1S/C15H31N3/c1-15(2,14-6-8-18(3)11-14)12-17-10-13-5-4-7-16-9-13/h13-14,16-17H,4-12H2,1-3H3
InChIKeyQTPSVFYTDFMDSC-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.55
Rot. Bonds5

About 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine

2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine (PubChem CID 115209785) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine
PubChem CID115209785
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine
SMILESCN1CCC(C(C)(C)CNCC2CCCNC2)C1
InChIInChI=1S/C15H31N3/c1-15(2,14-6-8-18(3)11-14)12-17-10-13-5-4-7-16-9-13/h13-14,16-17H,4-12H2,1-3H3
InChIKeyQTPSVFYTDFMDSC-UHFFFAOYSA-N
XLogP1.55
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclobutyl-2-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 115209786
3-[[[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]amino]methyl]cyclobutan-1-amine
CID 115214441
2-[[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]amino]acetaldehyde
CID 115223620
2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine
CID 115239317
2-N,2-N,2-trimethyl-1-N-(piperidin-3-ylmethyl)propane-1,2-diamine
CID 80553591
N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperazine-1-carboxamide
CID 115171658
N-[(1-methylpyrrolidin-3-yl)methyl]-1-pyrrolidin-3-ylmethanamine
CID 115208872
N-(azetidin-3-ylmethyl)-2-cyclohexyl-2-methylpropan-1-amine
CID 115208032
2-methyl-2-(1-methylpiperidin-3-yl)-N-(morpholin-3-ylmethyl)propan-1-amine
CID 115238229
N-[[(3R)-piperidin-3-yl]methyl]ethanamine
CID 86317945
N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide
CID 115191509
N-(chloromethyl)-2-methyl-2-(1-methylpiperidin-3-yl)propan-1-amine
CID 115263731

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine?
The IUPAC name of 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine (CID 115209785) is 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine?
The canonical SMILES for 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine is CN1CCC(C(C)(C)CNCC2CCCNC2)C1.
What is the InChIKey of 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine?
The InChIKey is QTPSVFYTDFMDSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-15(2,14-6-8-18(3)11-14)12-17-10-13-5-4-7-16-9-13/h13-14,16-17H,4-12H2,1-3H3.
What are the key properties of 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine?
2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(piperidin-3-ylmethyl)propan-1-amine is sourced from PubChem (CID 115209785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).