N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine

C12H24N2 — CID 115705721

IUPACN-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine
SMILESCCC(C)NC1CC(C)N(C2CC2)C1
InChIInChI=1S/C12H24N2/c1-4-9(2)13-11-7-10(3)14(8-11)12-5-6-12/h9-13H,4-8H2,1-3H3
InChIKeyARYSGABQKXZEGX-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.00
Rot. Bonds4

About N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine

N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine (PubChem CID 115705721) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine
PubChem CID115705721
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine
SMILESCCC(C)NC1CC(C)N(C2CC2)C1
InChIInChI=1S/C12H24N2/c1-4-9(2)13-11-7-10(3)14(8-11)12-5-6-12/h9-13H,4-8H2,1-3H3
InChIKeyARYSGABQKXZEGX-UHFFFAOYSA-N
XLogP2.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(1-cyclopropyl-5-methylpyrrolidin-3-yl)amino]propan-1-ol
CID 103789093
1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-5-methylpyrrolidin-3-amine
CID 115719729
1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine
CID 115722032
1-cyclopropyl-N-(3,3-dimethylbutan-2-yl)-5-methylpyrrolidin-3-amine
CID 115719166
1-cyclopropyl-5-methyl-N-[1-(2-methylphenyl)propan-2-yl]pyrrolidin-3-amine
CID 115713788
1-cyclopropyl-5-methyl-N-[1-(5-methylthiophen-2-yl)propan-2-yl]pyrrolidin-3-amine
CID 115722163
1-cyclopropyl-5-methyl-N-propylpyrrolidin-3-amine
CID 115704306
methyl (2S)-2-[(1-cyclopropyl-5-methylpyrrolidin-3-yl)amino]propanoate
CID 104866700
N-[1-(3-chlorophenyl)propan-2-yl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
CID 115713569
1-cyclopropyl-5-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine
CID 115713136
N-butan-2-yl-1-ethyl-2-methylpiperidin-4-amine
CID 115705729
1-cyclopropyl-5-methyl-N-[(1R)-1-(4-methylphenyl)ethyl]pyrrolidin-3-amine
CID 104866703

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine?
The IUPAC name of N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine (CID 115705721) is N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine.
What is the SMILES notation for N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine?
The canonical SMILES for N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine is CCC(C)NC1CC(C)N(C2CC2)C1.
What is the InChIKey of N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine?
The InChIKey is ARYSGABQKXZEGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-4-9(2)13-11-7-10(3)14(8-11)12-5-6-12/h9-13H,4-8H2,1-3H3.
What are the key properties of N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine?
N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine has a molecular weight of 196.34 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine is sourced from PubChem (CID 115705721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).