(3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine

C9H20N2 — CID 129222465

IUPAC(3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)N(C)[C@@H]1CCN(C)C1
InChIInChI=1S/C9H20N2/c1-8(2)11(4)9-5-6-10(3)7-9/h8-9H,5-7H2,1-4H3/t9-/m1/s1
InChIKeyPZOWGIAHGMYOCO-SECBINFHSA-N
MW156.27 g/mol
LogP1.03
Rot. Bonds2

About (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine

(3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine (PubChem CID 129222465) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine
PubChem CID129222465
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name(3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)N(C)[C@@H]1CCN(C)C1
InChIInChI=1S/C9H20N2/c1-8(2)11(4)9-5-6-10(3)7-9/h8-9H,5-7H2,1-4H3/t9-/m1/s1
InChIKeyPZOWGIAHGMYOCO-SECBINFHSA-N
XLogP1.03
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine (CID 129222465) is (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine is CC(C)N(C)[C@@H]1CCN(C)C1.
What is the InChIKey of (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine?
The InChIKey is PZOWGIAHGMYOCO-SECBINFHSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(2)11(4)9-5-6-10(3)7-9/h8-9H,5-7H2,1-4H3/t9-/m1/s1.
What are the key properties of (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine?
(3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine has a molecular weight of 156.27 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 129222465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).