2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide

C8H12N4O2S — CID 62150401

IUPAC2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide
SMILESNc1ncc(S(=O)(=O)NCC2CC2)cn1
InChIInChI=1S/C8H12N4O2S/c9-8-10-4-7(5-11-8)15(13,14)12-3-6-1-2-6/h4-6,12H,1-3H2,(H2,9,10,11)
InChIKeyPYBNPTRTPGYOKZ-UHFFFAOYSA-N
MW228.28 g/mol
LogP-0.25
Rot. Bonds4

About 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide

2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide (PubChem CID 62150401) has the molecular formula C8H12N4O2S and a molecular weight of 228.28 g/mol. Its IUPAC name is 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide
PubChem CID62150401
Molecular FormulaC8H12N4O2S
Molecular Weight228.28 g/mol
Exact Mass228.07
IUPAC Name2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide
SMILESNc1ncc(S(=O)(=O)NCC2CC2)cn1
InChIInChI=1S/C8H12N4O2S/c9-8-10-4-7(5-11-8)15(13,14)12-3-6-1-2-6/h4-6,12H,1-3H2,(H2,9,10,11)
InChIKeyPYBNPTRTPGYOKZ-UHFFFAOYSA-N
XLogP-0.25
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[(1-methylpiperidin-4-yl)methyl]pyrimidine-5-sulfonamide
CID 55043468
2-chloro-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide
CID 43456299
2-amino-N-(thian-2-ylmethyl)pyrimidine-5-sulfonamide
CID 80613102
N-(cyclopropylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide
CID 62150077
2-hydrazinyl-N-[(4-methylcyclohexyl)methyl]pyrimidine-5-sulfonamide
CID 63244262
2-chloro-N-[(4-ethylcyclohexyl)methyl]pyrimidine-5-sulfonamide
CID 61053689
2-amino-N-ethylpyrimidine-5-sulfonamide
CID 62148318
2-(methylamino)-N-[(4-methylcyclohexyl)methyl]pyrimidine-5-sulfonamide
CID 63244295
2-amino-N-(2-cyclopentyloxyethyl)pyrimidine-5-sulfonamide
CID 55260708
6-hydrazinyl-N-[(4-methylcyclohexyl)methyl]pyridine-3-sulfonamide
CID 63244170
6-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107411147
2-[(2-aminopyrimidin-5-yl)sulfonylamino]-N-cyclopropylacetamide
CID 62147002

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide (CID 62150401) is 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide is Nc1ncc(S(=O)(=O)NCC2CC2)cn1.
What is the InChIKey of 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide?
The InChIKey is PYBNPTRTPGYOKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2S/c9-8-10-4-7(5-11-8)15(13,14)12-3-6-1-2-6/h4-6,12H,1-3H2,(H2,9,10,11).
What are the key properties of 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide?
2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide has a molecular weight of 228.28 g/mol, XLogP of -0.25, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 62150401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).