1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine

C10H21N3 — CID 171531791

IUPAC1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine
SMILESC=C(CN(C)C)N1CCCC1NC
InChIInChI=1S/C10H21N3/c1-9(8-12(3)4)13-7-5-6-10(13)11-2/h10-11H,1,5-8H2,2-4H3
InChIKeyGIMJOJQDZXJXOR-UHFFFAOYSA-N
MW183.30 g/mol
LogP0.70
Rot. Bonds4

About 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine

1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine (PubChem CID 171531791) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine.

Molecular Properties

Compound Name1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine
PubChem CID171531791
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine
SMILESC=C(CN(C)C)N1CCCC1NC
InChIInChI=1S/C10H21N3/c1-9(8-12(3)4)13-7-5-6-10(13)11-2/h10-11H,1,5-8H2,2-4H3
InChIKeyGIMJOJQDZXJXOR-UHFFFAOYSA-N
XLogP0.70
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine?
The IUPAC name of 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine (CID 171531791) is 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine.
What is the SMILES notation for 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine?
The canonical SMILES for 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine is C=C(CN(C)C)N1CCCC1NC.
What is the InChIKey of 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine?
The InChIKey is GIMJOJQDZXJXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-9(8-12(3)4)13-7-5-6-10(13)11-2/h10-11H,1,5-8H2,2-4H3.
What are the key properties of 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine?
1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine has a molecular weight of 183.30 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine is sourced from PubChem (CID 171531791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).