3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine

C14H29N3O — CID 63169633

IUPAC3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine
SMILESCOCC(C)(CN)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C14H29N3O/c1-14(11-15,12-18-2)17-9-6-13(10-17)16-7-4-3-5-8-16/h13H,3-12,15H2,1-2H3
InChIKeySELLPNWFZZUSHT-UHFFFAOYSA-N
MW255.41 g/mol
LogP0.91
Rot. Bonds5

About 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine

3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine (PubChem CID 63169633) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine
PubChem CID63169633
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine
SMILESCOCC(C)(CN)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C14H29N3O/c1-14(11-15,12-18-2)17-9-6-13(10-17)16-7-4-3-5-8-16/h13H,3-12,15H2,1-2H3
InChIKeySELLPNWFZZUSHT-UHFFFAOYSA-N
XLogP0.91
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-3-methoxy-2-methylpropan-1-amine
CID 55166749
3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine
CID 62534739
2-cyclopropyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-1-amine
CID 63171783
3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 103494738
(3S)-1-tert-butyl-3-pyrrolidin-1-ylpyrrolidine
CID 166567497
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-2,4-dimethylpentan-1-amine
CID 63150020
3-methoxy-2-methyl-2-(2-methylpiperidin-1-yl)propan-1-amine
CID 62534541
3-methoxy-2-methyl-2-(4-methylpiperazin-1-yl)propan-1-amine
CID 62534542
2-(2,6-dimethylmorpholin-4-yl)-3-methoxy-2-methylpropan-1-amine
CID 62534733
N,2-dimethyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-1-amine
CID 117044509
2-methyl-2-(3-morpholin-4-ylpyrrolidin-1-yl)octan-1-amine
CID 63169684
1-[(3S)-1-tert-butylpyrrolidin-3-yl]-4-methoxypiperidine
CID 166567506

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine?
The IUPAC name of 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine (CID 63169633) is 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine.
What is the SMILES notation for 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine?
The canonical SMILES for 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine is COCC(C)(CN)N1CCC(N2CCCCC2)C1.
What is the InChIKey of 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine?
The InChIKey is SELLPNWFZZUSHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-14(11-15,12-18-2)17-9-6-13(10-17)16-7-4-3-5-8-16/h13H,3-12,15H2,1-2H3.
What are the key properties of 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine?
3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine has a molecular weight of 255.41 g/mol, XLogP of 0.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine is sourced from PubChem (CID 63169633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).