6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine

C19H20N6 — CID 97156382

IUPAC6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine
SMILESCc1nc(-c2ccncc2)ncc1[C@@H](C)Nc1cc(C2CC2)ncn1
InChIInChI=1S/C19H20N6/c1-12(24-18-9-17(14-3-4-14)22-11-23-18)16-10-21-19(25-13(16)2)15-5-7-20-8-6-15/h5-12,14H,3-4H2,1-2H3,(H,22,23,24)/t12-/m1/s1
InChIKeyCJTCVSKGVRPLOK-GFCCVEGCSA-N
MW332.41 g/mol
LogP3.69
Rot. Bonds5

About 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine

6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine (PubChem CID 97156382) has the molecular formula C19H20N6 and a molecular weight of 332.41 g/mol. Its IUPAC name is 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine
PubChem CID97156382
Molecular FormulaC19H20N6
Molecular Weight332.41 g/mol
Exact Mass332.17
IUPAC Name6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine
SMILESCc1nc(-c2ccncc2)ncc1[C@@H](C)Nc1cc(C2CC2)ncn1
InChIInChI=1S/C19H20N6/c1-12(24-18-9-17(14-3-4-14)22-11-23-18)16-10-21-19(25-13(16)2)15-5-7-20-8-6-15/h5-12,14H,3-4H2,1-2H3,(H,22,23,24)/t12-/m1/s1
InChIKeyCJTCVSKGVRPLOK-GFCCVEGCSA-N
XLogP3.69
TPSA76.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine (CID 97156382) is 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine is Cc1nc(-c2ccncc2)ncc1[C@@H](C)Nc1cc(C2CC2)ncn1.
What is the InChIKey of 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine?
The InChIKey is CJTCVSKGVRPLOK-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H20N6/c1-12(24-18-9-17(14-3-4-14)22-11-23-18)16-10-21-19(25-13(16)2)15-5-7-20-8-6-15/h5-12,14H,3-4H2,1-2H3,(H,22,23,24)/t12-/m1/s1.
What are the key properties of 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine?
6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine has a molecular weight of 332.41 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 97156382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).