1-methyl-5-propan-2-ylpyrrolidin-3-amine

C8H18N2 — CID 83855177

IUPAC1-methyl-5-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)C1CC(N)CN1C
InChIInChI=1S/C8H18N2/c1-6(2)8-4-7(9)5-10(8)3/h6-8H,4-5,9H2,1-3H3
InChIKeyHFLYDSMTBUWDFO-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.67
Rot. Bonds1

About 1-methyl-5-propan-2-ylpyrrolidin-3-amine

1-methyl-5-propan-2-ylpyrrolidin-3-amine (PubChem CID 83855177) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 1-methyl-5-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-methyl-5-propan-2-ylpyrrolidin-3-amine
PubChem CID83855177
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name1-methyl-5-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)C1CC(N)CN1C
InChIInChI=1S/C8H18N2/c1-6(2)8-4-7(9)5-10(8)3/h6-8H,4-5,9H2,1-3H3
InChIKeyHFLYDSMTBUWDFO-UHFFFAOYSA-N
XLogP0.67
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of 1-methyl-5-propan-2-ylpyrrolidin-3-amine (CID 83855177) is 1-methyl-5-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for 1-methyl-5-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for 1-methyl-5-propan-2-ylpyrrolidin-3-amine is CC(C)C1CC(N)CN1C.
What is the InChIKey of 1-methyl-5-propan-2-ylpyrrolidin-3-amine?
The InChIKey is HFLYDSMTBUWDFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-6(2)8-4-7(9)5-10(8)3/h6-8H,4-5,9H2,1-3H3.
What are the key properties of 1-methyl-5-propan-2-ylpyrrolidin-3-amine?
1-methyl-5-propan-2-ylpyrrolidin-3-amine has a molecular weight of 142.25 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 83855177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).