3-(1-methylpyrrolidin-3-yl)propan-1-amine

C8H18N2 — CID 23009458

IUPAC3-(1-methylpyrrolidin-3-yl)propan-1-amine
SMILESCN1CCC(CCCN)C1
InChIInChI=1S/C8H18N2/c1-10-6-4-8(7-10)3-2-5-9/h8H,2-7,9H2,1H3
InChIKeyRLIPJKXTTARVGJ-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.68
Rot. Bonds3

About 3-(1-methylpyrrolidin-3-yl)propan-1-amine

3-(1-methylpyrrolidin-3-yl)propan-1-amine (PubChem CID 23009458) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 3-(1-methylpyrrolidin-3-yl)propan-1-amine.

Molecular Properties

Compound Name3-(1-methylpyrrolidin-3-yl)propan-1-amine
PubChem CID23009458
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name3-(1-methylpyrrolidin-3-yl)propan-1-amine
SMILESCN1CCC(CCCN)C1
InChIInChI=1S/C8H18N2/c1-10-6-4-8(7-10)3-2-5-9/h8H,2-7,9H2,1H3
InChIKeyRLIPJKXTTARVGJ-UHFFFAOYSA-N
XLogP0.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Methyl-4-(pyrrolidin-3-yl)piperidine
CID 64434666
2-(1-Methylpiperidin-3-yl)ethan-1-amine
CID 12253960
3-Propylpyrrolidine
CID 12648198
2-Sec-butylpyrrolidine
CID 3563411
3-Butylpyrrolidine
CID 17389761
2-(1-Methylpyrrolidin-3-yl)ethan-1-amine
CID 22022480
3-Methyl-3-propylpyrrolidine
CID 22393542
3-(2-Methylpropyl)pyrrolidine
CID 22975332
3-(1-Methylpiperidin-4-yl)propan-1-amine
CID 23498080
3-Isopentylpyrrolidine
CID 53409754
4-[3-(Pyrrolidin-1-yl)propyl]piperidine
CID 62211827
1-Methyl-3-(pyrrolidin-3-yl)pyrrolidine
CID 64436959

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrrolidin-3-yl)propan-1-amine?
The IUPAC name of 3-(1-methylpyrrolidin-3-yl)propan-1-amine (CID 23009458) is 3-(1-methylpyrrolidin-3-yl)propan-1-amine.
What is the SMILES notation for 3-(1-methylpyrrolidin-3-yl)propan-1-amine?
The canonical SMILES for 3-(1-methylpyrrolidin-3-yl)propan-1-amine is CN1CCC(CCCN)C1.
What is the InChIKey of 3-(1-methylpyrrolidin-3-yl)propan-1-amine?
The InChIKey is RLIPJKXTTARVGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-10-6-4-8(7-10)3-2-5-9/h8H,2-7,9H2,1H3.
What are the key properties of 3-(1-methylpyrrolidin-3-yl)propan-1-amine?
3-(1-methylpyrrolidin-3-yl)propan-1-amine has a molecular weight of 142.25 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrrolidin-3-yl)propan-1-amine is sourced from PubChem (CID 23009458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).