[(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine

C10H22N2 — CID 93497649

IUPAC[(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine
SMILESCC(C)CCN1CCC[C@@H]1CN
InChIInChI=1S/C10H22N2/c1-9(2)5-7-12-6-3-4-10(12)8-11/h9-10H,3-8,11H2,1-2H3/t10-/m1/s1
InChIKeyWBRZULPNYDEOPL-SNVBAGLBSA-N
MW170.30 g/mol
LogP1.46
Rot. Bonds4

About [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine

[(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine (PubChem CID 93497649) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine
PubChem CID93497649
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name[(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine
SMILESCC(C)CCN1CCC[C@@H]1CN
InChIInChI=1S/C10H22N2/c1-9(2)5-7-12-6-3-4-10(12)8-11/h9-10H,3-8,11H2,1-2H3/t10-/m1/s1
InChIKeyWBRZULPNYDEOPL-SNVBAGLBSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromopropyl)-1-(3-methylbutyl)pyrrolidine
CID 80691753
1-[4-[1-(3-methylbutyl)pyrrolidin-2-yl]butyl]piperidin-4-amine
CID 155082325
(1-nonylpyrrolidin-2-yl)methanamine
CID 19780174
[1-(2-propan-2-ylsulfonylethyl)pyrrolidin-2-yl]methanamine
CID 84698058
ethane;(1-ethylpyrrolidin-2-yl)methanamine
CID 142961136
[(2R)-1-ethylpyrrolidin-2-yl]methanamine;hydrochloride
CID 46738121
[1-(2-ethylsulfanylethyl)pyrrolidin-2-yl]methanamine
CID 112702102
ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane
CID 142875932
[1-(2-cyclohexylethyl)pyrrolidin-2-yl]methanamine
CID 81493135
3-[2-(aminomethyl)pyrrolidin-1-yl]propanenitrile
CID 73062219
[1-(4-methylsulfanylbutyl)pyrrolidin-2-yl]methanamine
CID 103089527
1-[[(2S)-1-(3-methylbutyl)pyrrolidin-2-yl]methyl]-1,2,4-triazole
CID 95307748

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine?
The IUPAC name of [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine (CID 93497649) is [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine?
The canonical SMILES for [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine is CC(C)CCN1CCC[C@@H]1CN.
What is the InChIKey of [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine?
The InChIKey is WBRZULPNYDEOPL-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H22N2/c1-9(2)5-7-12-6-3-4-10(12)8-11/h9-10H,3-8,11H2,1-2H3/t10-/m1/s1.
What are the key properties of [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine?
[(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine has a molecular weight of 170.30 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 93497649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).