3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine

C11H25N3 — CID 170055778

IUPAC3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine
SMILESCC(C)N(C)CCC1(C)CCN(N)C1
InChIInChI=1S/C11H25N3/c1-10(2)13(4)7-5-11(3)6-8-14(12)9-11/h10H,5-9,12H2,1-4H3
InChIKeyOZRQYPZNXXYOQG-UHFFFAOYSA-N
MW199.34 g/mol
LogP1.30
Rot. Bonds4

About 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine

3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine (PubChem CID 170055778) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine.

Molecular Properties

Compound Name3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine
PubChem CID170055778
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC Name3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine
SMILESCC(C)N(C)CCC1(C)CCN(N)C1
InChIInChI=1S/C11H25N3/c1-10(2)13(4)7-5-11(3)6-8-14(12)9-11/h10H,5-9,12H2,1-4H3
InChIKeyOZRQYPZNXXYOQG-UHFFFAOYSA-N
XLogP1.30
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine?
The IUPAC name of 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine (CID 170055778) is 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine.
What is the SMILES notation for 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine?
The canonical SMILES for 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine is CC(C)N(C)CCC1(C)CCN(N)C1.
What is the InChIKey of 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine?
The InChIKey is OZRQYPZNXXYOQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-10(2)13(4)7-5-11(3)6-8-14(12)9-11/h10H,5-9,12H2,1-4H3.
What are the key properties of 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine?
3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine has a molecular weight of 199.34 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine is sourced from PubChem (CID 170055778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).