N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine

C10H12FN5 — CID 103858283

IUPACN-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine
SMILESCc1c(CNc2ncc(F)cn2)cnn1C
InChIInChI=1S/C10H12FN5/c1-7-8(4-15-16(7)2)3-12-10-13-5-9(11)6-14-10/h4-6H,3H2,1-2H3,(H,12,13,14)
InChIKeyUARHLMICWGMZRW-UHFFFAOYSA-N
MW221.24 g/mol
LogP1.27
Rot. Bonds3

About N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine

N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine (PubChem CID 103858283) has the molecular formula C10H12FN5 and a molecular weight of 221.24 g/mol. Its IUPAC name is N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine.

Molecular Properties

Compound NameN-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine
PubChem CID103858283
Molecular FormulaC10H12FN5
Molecular Weight221.24 g/mol
Exact Mass221.11
IUPAC NameN-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine
SMILESCc1c(CNc2ncc(F)cn2)cnn1C
InChIInChI=1S/C10H12FN5/c1-7-8(4-15-16(7)2)3-12-10-13-5-9(11)6-14-10/h4-6H,3H2,1-2H3,(H,12,13,14)
InChIKeyUARHLMICWGMZRW-UHFFFAOYSA-N
XLogP1.27
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[3-Methyl-4-[[4-(methylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]pyrazol-1-yl]propanenitrile
CID 67814206
3-[5-Methyl-4-[[4-(methylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]pyrazol-1-yl]propanenitrile
CID 67818467
2-N-(1-ethyl-3-methylpyrazol-4-yl)-4-N-methyl-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 67988921
4-N-methyl-2-N-(5-methyl-1-propan-2-ylpyrazol-4-yl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 69093006
2-N-(1,5-dimethylpyrazol-4-yl)-4-N-methyl-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 69281523
4-N-methyl-2-N-(3-methyl-1-propan-2-ylpyrazol-4-yl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 69281529
2-N-(1,3-dimethylpyrazol-4-yl)-4-N-methyl-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 69281678
2-N-(1-ethyl-5-methylpyrazol-4-yl)-4-N-methyl-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 69281708
US9932325, Example 109
CID 69093358
N-(1,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-2-pyrimidinamine
CID 134129122
US11214565, Example D-13
CID 135374687
N~4~,6-dimethyl-N~4~-[3-(1H-pyrazol-1-yl)propyl]-2,4-pyrimidinediamine
CID 39782655

Frequently Asked Questions

What is the IUPAC name of N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine?
The IUPAC name of N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine (CID 103858283) is N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine.
What is the SMILES notation for N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine?
The canonical SMILES for N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine is Cc1c(CNc2ncc(F)cn2)cnn1C.
What is the InChIKey of N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine?
The InChIKey is UARHLMICWGMZRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN5/c1-7-8(4-15-16(7)2)3-12-10-13-5-9(11)6-14-10/h4-6H,3H2,1-2H3,(H,12,13,14).
What are the key properties of N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine?
N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine has a molecular weight of 221.24 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-fluoropyrimidin-2-amine is sourced from PubChem (CID 103858283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).