4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine

C11H16FN3 — CID 115417124

IUPAC4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine
SMILESCC1CCC(C)N(c2cc(F)ncn2)C1
InChIInChI=1S/C11H16FN3/c1-8-3-4-9(2)15(6-8)11-5-10(12)13-7-14-11/h5,7-9H,3-4,6H2,1-2H3
InChIKeyMSJCSYUQKIGFIV-UHFFFAOYSA-N
MW209.27 g/mol
LogP2.24
Rot. Bonds1

About 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine

4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine (PubChem CID 115417124) has the molecular formula C11H16FN3 and a molecular weight of 209.27 g/mol. Its IUPAC name is 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine.

Molecular Properties

Compound Name4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine
PubChem CID115417124
Molecular FormulaC11H16FN3
Molecular Weight209.27 g/mol
Exact Mass209.13
IUPAC Name4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine
SMILESCC1CCC(C)N(c2cc(F)ncn2)C1
InChIInChI=1S/C11H16FN3/c1-8-3-4-9(2)15(6-8)11-5-10(12)13-7-14-11/h5,7-9H,3-4,6H2,1-2H3
InChIKeyMSJCSYUQKIGFIV-UHFFFAOYSA-N
XLogP2.24
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine 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

4,6-Bispiperidinopyrimidine
CID 612543
N4-cyclohexyl-N4,N6-dimethylpyrimidine-4,6-diamine
CID 80761773
2,4-Difluoro-6-piperidinopyrimidine
CID 598527
2-Chloro-4-(4-methylpiperidin-1-yl)pyrimidine
CID 21939227
4-N-cyclohexyl-2-N,2-N,4-N-trimethylpyrimidine-2,4-diamine
CID 75421941
2-N,2-N,4-N-trimethyl-4-N-(1-propan-2-ylpiperidin-4-yl)pyrimidine-2,4-diamine
CID 75421951
N,N-dimethyl-6-(piperidin-1-yl)pyrimidin-4-amine
CID 122281919
2-Chloro-4-(3,3-dimethylpiperidin-1-yl)pyrimidine
CID 22308337
N-[6-(3-aminopiperidino)-4-pyrimidinyl]-N,N-dimethylamine
CID 53185813
N,N-dimethyl-6-[4-[(1S)-1-pyrrolidin-1-ylethyl]piperidin-1-yl]pyrimidin-4-amine
CID 97205568
2-N,2-N,4-N-trimethyl-4-N-[[(3S)-1-methylpiperidin-3-yl]methyl]pyrimidine-2,4-diamine
CID 97317804
2-N-methyl-2-N-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-2,4-diamine
CID 97438030

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine?
The IUPAC name of 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine (CID 115417124) is 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine.
What is the SMILES notation for 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine?
The canonical SMILES for 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine is CC1CCC(C)N(c2cc(F)ncn2)C1.
What is the InChIKey of 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine?
The InChIKey is MSJCSYUQKIGFIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3/c1-8-3-4-9(2)15(6-8)11-5-10(12)13-7-14-11/h5,7-9H,3-4,6H2,1-2H3.
What are the key properties of 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine?
4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine has a molecular weight of 209.27 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylpiperidin-1-yl)-6-fluoropyrimidine is sourced from PubChem (CID 115417124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).