2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine

C8H18N2 — CID 59033358

IUPAC2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine
SMILESCN1CC[C@@H](C(C)(C)N)C1
InChIInChI=1S/C8H18N2/c1-8(2,9)7-4-5-10(3)6-7/h7H,4-6,9H2,1-3H3/t7-/m1/s1
InChIKeyRAOQHQOFPOXVDV-SSDOTTSWSA-N
MW142.25 g/mol
LogP0.68
Rot. Bonds1

About 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine

2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine (PubChem CID 59033358) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine.

Molecular Properties

Compound Name2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine
PubChem CID59033358
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine
SMILESCN1CC[C@@H](C(C)(C)N)C1
InChIInChI=1S/C8H18N2/c1-8(2,9)7-4-5-10(3)6-7/h7H,4-6,9H2,1-3H3/t7-/m1/s1
InChIKeyRAOQHQOFPOXVDV-SSDOTTSWSA-N
XLogP0.68
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 ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-tert-butyl-1-methylpyrrolidine
CID 58837566
2-(1-methylpyrrolidin-3-yl)propane-2-thiol
CID 116866670
ethane;2-(1-methylpyrrolidin-3-yl)propan-2-ol
CID 166075678
O-[2-(1-methylpyrrolidin-3-yl)propan-2-yl]hydroxylamine
CID 117104630
1-methyl-3-(2-methylbutan-2-yl)pyrrolidine
CID 129106499
ethane;1-methyl-3-(trifluoromethyl)pyrrolidine
CID 177172924
1-methyl-3-(5-methylnonan-5-yl)pyrrolidine
CID 170333732
(3S)-3-tert-butyl-1-methylpiperidine
CID 129190972
4-[1-fluoro-1-(1-methylpyrrolidin-3-yl)ethyl]aniline
CID 115033493
2-amino-2-(1-methylpiperidin-4-yl)propanoic acid
CID 82602342
3-amino-3-methyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]butanamide
CID 115155136
2-methyl-1-(1-methylpiperidin-4-yl)propan-2-amine
CID 82598280

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine?
The IUPAC name of 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine (CID 59033358) is 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine.
What is the SMILES notation for 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine?
The canonical SMILES for 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine is CN1CC[C@@H](C(C)(C)N)C1.
What is the InChIKey of 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine?
The InChIKey is RAOQHQOFPOXVDV-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H18N2/c1-8(2,9)7-4-5-10(3)6-7/h7H,4-6,9H2,1-3H3/t7-/m1/s1.
What are the key properties of 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine?
2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine has a molecular weight of 142.25 g/mol, XLogP of 0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine is sourced from PubChem (CID 59033358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).