2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide

C11H17N5O2S — CID 62156639

IUPAC2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide
SMILESNc1ncc(S(=O)(=O)NC2CCN(C3CC3)C2)cn1
InChIInChI=1S/C11H17N5O2S/c12-11-13-5-10(6-14-11)19(17,18)15-8-3-4-16(7-8)9-1-2-9/h5-6,8-9,15H,1-4,7H2,(H2,12,13,14)
InChIKeyYQPLGBOADQLSIC-UHFFFAOYSA-N
MW283.36 g/mol
LogP-0.43
Rot. Bonds4

About 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide

2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide (PubChem CID 62156639) has the molecular formula C11H17N5O2S and a molecular weight of 283.36 g/mol. Its IUPAC name is 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide
PubChem CID62156639
Molecular FormulaC11H17N5O2S
Molecular Weight283.36 g/mol
Exact Mass283.11
IUPAC Name2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide
SMILESNc1ncc(S(=O)(=O)NC2CCN(C3CC3)C2)cn1
InChIInChI=1S/C11H17N5O2S/c12-11-13-5-10(6-14-11)19(17,18)15-8-3-4-16(7-8)9-1-2-9/h5-6,8-9,15H,1-4,7H2,(H2,12,13,14)
InChIKeyYQPLGBOADQLSIC-UHFFFAOYSA-N
XLogP-0.43
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide (CID 62156639) is 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide is Nc1ncc(S(=O)(=O)NC2CCN(C3CC3)C2)cn1.
What is the InChIKey of 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide?
The InChIKey is YQPLGBOADQLSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2S/c12-11-13-5-10(6-14-11)19(17,18)15-8-3-4-16(7-8)9-1-2-9/h5-6,8-9,15H,1-4,7H2,(H2,12,13,14).
What are the key properties of 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide?
2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide has a molecular weight of 283.36 g/mol, XLogP of -0.43, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 62156639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).