1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine

C11H24N2 — CID 79189172

IUPAC1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine
SMILESCCCC(N)CN1CC(C)C(C)C1
InChIInChI=1S/C11H24N2/c1-4-5-11(12)8-13-6-9(2)10(3)7-13/h9-11H,4-8,12H2,1-3H3
InChIKeyYCEXAEHJYQEYPE-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.70
Rot. Bonds4

About 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine

1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine (PubChem CID 79189172) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine.

Molecular Properties

Compound Name1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine
PubChem CID79189172
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine
SMILESCCCC(N)CN1CC(C)C(C)C1
InChIInChI=1S/C11H24N2/c1-4-5-11(12)8-13-6-9(2)10(3)7-13/h9-11H,4-8,12H2,1-3H3
InChIKeyYCEXAEHJYQEYPE-UHFFFAOYSA-N
XLogP1.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Aminomethyl-1-ethylpyrrolidine
CID 117295
2-(2,2-Dimethylpyrrolidin-1-yl)ethan-1-amine
CID 45157077
2-[3-(Aminomethyl)-1-pyrrolidinyl]-N,N-dimethylethanamine
CID 24696719
(S)-(-)-2-Aminomethyl-1-ethylpyrrolidine
CID 643457
(2R)-1-Ethyl-2-pyrrolidinemethanamine
CID 854138
(1-(Butan-2-yl)pyrrolidin-3-yl)methanamine
CID 17389968
(S)-N-Ethyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 7141622
((2S)-1-methylpyrrolidin-2-yl)methanamine
CID 21307221
4-Methyl-1-(propan-2-yl)pyrrolidin-3-amine
CID 58030188
2-(2-Methylpyrrolidin-1-yl)ethan-1-amine
CID 15154301
(1-(Propan-2-yl)pyrrolidin-3-yl)methanamine
CID 21978903
1-Methylpyrrolidine-2-methylamine
CID 117300

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine?
The IUPAC name of 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine (CID 79189172) is 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine.
What is the SMILES notation for 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine?
The canonical SMILES for 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine is CCCC(N)CN1CC(C)C(C)C1.
What is the InChIKey of 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine?
The InChIKey is YCEXAEHJYQEYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-5-11(12)8-13-6-9(2)10(3)7-13/h9-11H,4-8,12H2,1-3H3.
What are the key properties of 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine?
1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine has a molecular weight of 184.33 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylpyrrolidin-1-yl)pentan-2-amine is sourced from PubChem (CID 79189172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).