[5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine

C15H24N2 — CID 113319943

IUPAC[5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine
SMILESCC1CC(CN)CN1CCCc1ccccc1
InChIInChI=1S/C15H24N2/c1-13-10-15(11-16)12-17(13)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,13,15H,5,8-12,16H2,1H3
InChIKeyAOEROUQKYHJYKH-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.29
Rot. Bonds5

About [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine

[5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine (PubChem CID 113319943) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine
PubChem CID113319943
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name[5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine
SMILESCC1CC(CN)CN1CCCc1ccccc1
InChIInChI=1S/C15H24N2/c1-13-10-15(11-16)12-17(13)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,13,15H,5,8-12,16H2,1H3
InChIKeyAOEROUQKYHJYKH-UHFFFAOYSA-N
XLogP2.29
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-1-(3-phenylpropyl)piperidin-3-amine
CID 61238461
[4-methyl-1-(3-phenylpropyl)piperazin-2-yl]methanamine
CID 80504597
2-[4-(aminomethyl)-2-methylpyrrolidin-1-yl]ethanamine
CID 130892102
(5-methyl-1-propylpyrrolidin-3-yl)methanamine
CID 115486103
(3R,7R,8aR)-3-methyl-2-(3-phenylpropyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-7-ol
CID 95857055
(5-methyl-1-pent-4-enylpyrrolidin-3-yl)methanamine
CID 115486286
[5-methyl-1-(naphthalen-2-ylmethyl)pyrrolidin-3-yl]methanamine
CID 115486401
(3R,5S)-1-(3-phenylpropyl)piperidine-3,5-diamine
CID 118550630
(5-benzyl-1-methylpyrrolidin-3-yl)methanamine
CID 83855321
[1-[2-(4-ethoxyphenoxy)ethyl]-5-methylpyrrolidin-3-yl]methanamine
CID 115486226
[1-(4-phenylbutyl)piperidin-4-yl]methanamine
CID 69419059
2,3-dimethyl-1-(3-phenylpropyl)piperidin-4-amine
CID 79397057

Frequently Asked Questions

What is the IUPAC name of [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine?
The IUPAC name of [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine (CID 113319943) is [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine is CC1CC(CN)CN1CCCc1ccccc1.
What is the InChIKey of [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine?
The InChIKey is AOEROUQKYHJYKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-13-10-15(11-16)12-17(13)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,13,15H,5,8-12,16H2,1H3.
What are the key properties of [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine?
[5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine has a molecular weight of 232.37 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 113319943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).