4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine

C13H18N6 — CID 146989000

IUPAC4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine
SMILESCn1nccc1-c1ccnc(N[C@@H]2CCCNC2)n1
InChIInChI=1S/C13H18N6/c1-19-12(5-8-16-19)11-4-7-15-13(18-11)17-10-3-2-6-14-9-10/h4-5,7-8,10,14H,2-3,6,9H2,1H3,(H,15,17,18)/t10-/m1/s1
InChIKeyAPVBJMMRZJLTBR-SNVBAGLBSA-N
MW258.33 g/mol
LogP1.04
Rot. Bonds3

About 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine

4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine (PubChem CID 146989000) has the molecular formula C13H18N6 and a molecular weight of 258.33 g/mol. Its IUPAC name is 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine
PubChem CID146989000
Molecular FormulaC13H18N6
Molecular Weight258.33 g/mol
Exact Mass258.16
IUPAC Name4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine
SMILESCn1nccc1-c1ccnc(N[C@@H]2CCCNC2)n1
InChIInChI=1S/C13H18N6/c1-19-12(5-8-16-19)11-4-7-15-13(18-11)17-10-3-2-6-14-9-10/h4-5,7-8,10,14H,2-3,6,9H2,1H3,(H,15,17,18)/t10-/m1/s1
InChIKeyAPVBJMMRZJLTBR-SNVBAGLBSA-N
XLogP1.04
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.33
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-cyclopropyl-N-piperidin-3-ylpyrimidin-2-amine
CID 83836771
N-[(3S)-piperidin-3-yl]-4-pyridazin-4-ylpyrimidin-2-amine
CID 175699091
4-[2-(oxan-4-yl)pyrazol-3-yl]-N-pyrrolidin-3-ylpyrimidin-2-amine
CID 166300698
4-chloro-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine
CID 71640268
4-(azepan-1-yl)-N-piperidin-3-ylpyrimidin-2-amine
CID 66903769
[3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol
CID 176741120
N-cyclobutyl-4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-amine
CID 46985481
ethane;1-[3-[2-(piperidin-3-ylamino)pyrimidin-4-yl]imidazo[1,2-a]pyrazin-6-yl]pyrrolidin-2-one
CID 167450026
2-(2-methylpyrazol-3-yl)-5-(piperidin-3-ylmethyl)pyridine
CID 110102100
ethane;2-[7-methoxy-3-[2-(piperidin-3-ylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 170591549
4-(2-methylpyrazol-3-yl)-2-piperazin-1-ylpyrimidine
CID 106758887
2-(2-methylpyrazol-3-yl)-6-[[(3S)-piperidin-3-yl]methyl]pyrazine
CID 125014329

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine?
The IUPAC name of 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine (CID 146989000) is 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine?
The canonical SMILES for 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine is Cn1nccc1-c1ccnc(N[C@@H]2CCCNC2)n1.
What is the InChIKey of 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine?
The InChIKey is APVBJMMRZJLTBR-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H18N6/c1-19-12(5-8-16-19)11-4-7-15-13(18-11)17-10-3-2-6-14-9-10/h4-5,7-8,10,14H,2-3,6,9H2,1H3,(H,15,17,18)/t10-/m1/s1.
What are the key properties of 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine?
4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine has a molecular weight of 258.33 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine is sourced from PubChem (CID 146989000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).