2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine

C12H25N3 — CID 82945221

IUPAC2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine
SMILESCC(CN(C)C)NC1CCN(C2CC2)C1
InChIInChI=1S/C12H25N3/c1-10(8-14(2)3)13-11-6-7-15(9-11)12-4-5-12/h10-13H,4-9H2,1-3H3
InChIKeyDVZWDBVDNAHRBK-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.76
Rot. Bonds5

About 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine

2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine (PubChem CID 82945221) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine
PubChem CID82945221
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine
SMILESCC(CN(C)C)NC1CCN(C2CC2)C1
InChIInChI=1S/C12H25N3/c1-10(8-14(2)3)13-11-6-7-15(9-11)12-4-5-12/h10-13H,4-9H2,1-3H3
InChIKeyDVZWDBVDNAHRBK-UHFFFAOYSA-N
XLogP0.76
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine?
The IUPAC name of 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine (CID 82945221) is 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine.
What is the SMILES notation for 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine?
The canonical SMILES for 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine is CC(CN(C)C)NC1CCN(C2CC2)C1.
What is the InChIKey of 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine?
The InChIKey is DVZWDBVDNAHRBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-10(8-14(2)3)13-11-6-7-15(9-11)12-4-5-12/h10-13H,4-9H2,1-3H3.
What are the key properties of 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine?
2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine has a molecular weight of 211.35 g/mol, XLogP of 0.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-cyclopropylpyrrolidin-3-yl)-1-N,1-N-dimethylpropane-1,2-diamine is sourced from PubChem (CID 82945221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).