2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine

C11H24N2 — CID 106638144

IUPAC2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine
SMILESCCC(NCC1CCCN1)C(C)C
InChIInChI=1S/C11H24N2/c1-4-11(9(2)3)13-8-10-6-5-7-12-10/h9-13H,4-8H2,1-3H3
InChIKeyWZIMOYKLCUXMGN-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.76
Rot. Bonds5

About 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine

2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine (PubChem CID 106638144) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine.

Molecular Properties

Compound Name2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine
PubChem CID106638144
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine
SMILESCCC(NCC1CCCN1)C(C)C
InChIInChI=1S/C11H24N2/c1-4-11(9(2)3)13-8-10-6-5-7-12-10/h9-13H,4-8H2,1-3H3
InChIKeyWZIMOYKLCUXMGN-UHFFFAOYSA-N
XLogP1.76
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine?
The IUPAC name of 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine (CID 106638144) is 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine.
What is the SMILES notation for 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine?
The canonical SMILES for 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine is CCC(NCC1CCCN1)C(C)C.
What is the InChIKey of 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine?
The InChIKey is WZIMOYKLCUXMGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-11(9(2)3)13-8-10-6-5-7-12-10/h9-13H,4-8H2,1-3H3.
What are the key properties of 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine?
2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine has a molecular weight of 184.33 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-3-amine is sourced from PubChem (CID 106638144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).