(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine

C8H16N2 — CID 124709446

IUPAC(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine
SMILESC[C@@H]1CN(C2CC2)C[C@H]1N
InChIInChI=1S/C8H16N2/c1-6-4-10(5-8(6)9)7-2-3-7/h6-8H,2-5,9H2,1H3/t6-,8-/m1/s1
InChIKeyKJSCOXHVQCIXQY-HTRCEHHLSA-N
MW140.23 g/mol
LogP0.43
Rot. Bonds1

About (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine

(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine (PubChem CID 124709446) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine
PubChem CID124709446
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine
SMILESC[C@@H]1CN(C2CC2)C[C@H]1N
InChIInChI=1S/C8H16N2/c1-6-4-10(5-8(6)9)7-2-3-7/h6-8H,2-5,9H2,1H3/t6-,8-/m1/s1
InChIKeyKJSCOXHVQCIXQY-HTRCEHHLSA-N
XLogP0.43
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclooctyl-4-methylpyrrolidin-3-amine
CID 103575307
4-methyl-1-(1-propylpiperidin-4-yl)pyrrolidin-3-amine
CID 103575589
4-methyl-1-(2-methylcyclohexyl)pyrrolidin-3-amine
CID 103575116
1-(2,4-dimethylcyclohexyl)-4-methylpyrrolidin-3-amine
CID 103575548
1-(4-tert-butylcycloheptyl)-3-methylpiperidin-4-amine
CID 79880572
1-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-4-methylpyrrolidin-3-amine
CID 103575631
2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol
CID 103576741
3-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)piperidin-4-amine
CID 79880685
4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine
CID 62807250
1-(1-ethylazepan-4-yl)-4-methylpiperidin-3-amine
CID 65077439
1-(1-benzylpyrrolidin-3-yl)-4-methylpyrrolidin-3-amine
CID 103575535
(3R,4S)-1-cyclopropyl-4-ethyl-3-methylpiperidine
CID 134195657

Frequently Asked Questions

What is the IUPAC name of (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine?
The IUPAC name of (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine (CID 124709446) is (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine.
What is the SMILES notation for (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine?
The canonical SMILES for (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine is C[C@@H]1CN(C2CC2)C[C@H]1N.
What is the InChIKey of (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine?
The InChIKey is KJSCOXHVQCIXQY-HTRCEHHLSA-N. The full InChI is InChI=1S/C8H16N2/c1-6-4-10(5-8(6)9)7-2-3-7/h6-8H,2-5,9H2,1H3/t6-,8-/m1/s1.
What are the key properties of (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine?
(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine has a molecular weight of 140.23 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine is sourced from PubChem (CID 124709446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).