2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide

C9H12N4O — CID 54853977

IUPAC2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide
SMILESCNC(=O)c1cc(C2CC2)nc(N)n1
InChIInChI=1S/C9H12N4O/c1-11-8(14)7-4-6(5-2-3-5)12-9(10)13-7/h4-5H,2-3H2,1H3,(H,11,14)(H2,10,12,13)
InChIKeyMERSVFJESLGCRU-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.30
Rot. Bonds2

About 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide

2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide (PubChem CID 54853977) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide
PubChem CID54853977
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Name2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide
SMILESCNC(=O)c1cc(C2CC2)nc(N)n1
InChIInChI=1S/C9H12N4O/c1-11-8(14)7-4-6(5-2-3-5)12-9(10)13-7/h4-5H,2-3H2,1H3,(H,11,14)(H2,10,12,13)
InChIKeyMERSVFJESLGCRU-UHFFFAOYSA-N
XLogP0.30
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide (CID 54853977) is 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide is CNC(=O)c1cc(C2CC2)nc(N)n1.
What is the InChIKey of 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide?
The InChIKey is MERSVFJESLGCRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c1-11-8(14)7-4-6(5-2-3-5)12-9(10)13-7/h4-5H,2-3H2,1H3,(H,11,14)(H2,10,12,13).
What are the key properties of 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide?
2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide has a molecular weight of 192.22 g/mol, XLogP of 0.30, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-cyclopropyl-N-methylpyrimidine-4-carboxamide is sourced from PubChem (CID 54853977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).