2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine

C12H24N2 — CID 102776220

IUPAC2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine
SMILESCC(CNCC1NCCC1C)C1CC1
InChIInChI=1S/C12H24N2/c1-9-5-6-14-12(9)8-13-7-10(2)11-3-4-11/h9-14H,3-8H2,1-2H3
InChIKeyADOPNXRPNCGWOL-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.62
Rot. Bonds5

About 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine

2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine (PubChem CID 102776220) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine
PubChem CID102776220
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine
SMILESCC(CNCC1NCCC1C)C1CC1
InChIInChI=1S/C12H24N2/c1-9-5-6-14-12(9)8-13-7-10(2)11-3-4-11/h9-14H,3-8H2,1-2H3
InChIKeyADOPNXRPNCGWOL-UHFFFAOYSA-N
XLogP1.62
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-Ethyl-2,4-dimethylpyrrolidine
CID 249718
(2S)-4-methyl-1-(pyrrolidin-1-yl)pentan-2-amine
CID 22689529
2,3,4,5-Tetramethylpyrrolidine
CID 20546029
2-Methyl-4-(1-methylethyl)pyrrolidine
CID 55288086
(2S,4S)-2-methyl-4-propan-2-ylpyrrolidine
CID 124130916
3-Ethyl-2-(pyrrolidin-1-yl)pentan-1-amine
CID 42933680
1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine
CID 11970587
N,N-dimethyl-5-azaspiro[2.4]heptan-7-amine
CID 55299468
2-fluoro-N-[(3-methylpyrrolidin-2-yl)methyl]ethanamine
CID 130504613
2-fluoro-N-[[(4S)-4-methylpyrrolidin-2-yl]methyl]ethanamine
CID 169835945
[4-(2-Fluoroethyl)pyrrolidin-2-yl]methyl-trimethylazanium
CID 169860455
2-fluoro-N-methyl-N-[(4-methylpyrrolidin-2-yl)methyl]ethanamine
CID 169860456

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine?
The IUPAC name of 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine (CID 102776220) is 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine?
The canonical SMILES for 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine is CC(CNCC1NCCC1C)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine?
The InChIKey is ADOPNXRPNCGWOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-9-5-6-14-12(9)8-13-7-10(2)11-3-4-11/h9-14H,3-8H2,1-2H3.
What are the key properties of 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine?
2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 102776220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).