N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine

C15H31N3 — CID 63169567

IUPACN-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine
SMILESCCC(NC)C(C)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C15H31N3/c1-4-15(16-3)13(2)18-11-8-14(12-18)17-9-6-5-7-10-17/h13-16H,4-12H2,1-3H3
InChIKeyVKFRETJORBWXSG-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.93
Rot. Bonds5

About N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine

N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine (PubChem CID 63169567) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine.

Molecular Properties

Compound NameN-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine
PubChem CID63169567
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine
SMILESCCC(NC)C(C)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C15H31N3/c1-4-15(16-3)13(2)18-11-8-14(12-18)17-9-6-5-7-10-17/h13-16H,4-12H2,1-3H3
InChIKeyVKFRETJORBWXSG-UHFFFAOYSA-N
XLogP1.93
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-methylpentan-3-amine
CID 79938099
3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
CID 63171314
1-(1-propan-2-ylpyrrolidin-3-yl)piperidine
CID 58850224
(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine
CID 130210207
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 64707229
2-(3-ethylpentan-2-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79939262
2-(3-piperidin-1-ylpyrrolidin-1-yl)butanoic acid
CID 63170614
1-[(1S)-1-iodoethyl]-3-pyrrolidin-1-ylpyrrolidine
CID 130220331
N-methyl-2-(3-phenylpyrrolidin-1-yl)pentan-3-amine
CID 62132289
methyl 2-methyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butanoate
CID 79413832
2-methyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butanehydrazide
CID 79408685
N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 64706614

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine?
The IUPAC name of N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine (CID 63169567) is N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine.
What is the SMILES notation for N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine?
The canonical SMILES for N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine is CCC(NC)C(C)N1CCC(N2CCCCC2)C1.
What is the InChIKey of N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine?
The InChIKey is VKFRETJORBWXSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-4-15(16-3)13(2)18-11-8-14(12-18)17-9-6-5-7-10-17/h13-16H,4-12H2,1-3H3.
What are the key properties of N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine?
N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine has a molecular weight of 253.43 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine is sourced from PubChem (CID 63169567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).