N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide

C15H22N4O2 — CID 164635280

IUPACN-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide
SMILESCOc1cc(C(=O)NC[C@H]2CCCCN2C2CC2)ncn1
InChIInChI=1S/C15H22N4O2/c1-21-14-8-13(17-10-18-14)15(20)16-9-12-4-2-3-7-19(12)11-5-6-11/h8,10-12H,2-7,9H2,1H3,(H,16,20)/t12-/m1/s1
InChIKeyWDHZYFGGLBVKQU-GFCCVEGCSA-N
MW290.37 g/mol
LogP1.23
Rot. Bonds5

About N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide

N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide (PubChem CID 164635280) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide
PubChem CID164635280
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide
SMILESCOc1cc(C(=O)NC[C@H]2CCCCN2C2CC2)ncn1
InChIInChI=1S/C15H22N4O2/c1-21-14-8-13(17-10-18-14)15(20)16-9-12-4-2-3-7-19(12)11-5-6-11/h8,10-12H,2-7,9H2,1H3,(H,16,20)/t12-/m1/s1
InChIKeyWDHZYFGGLBVKQU-GFCCVEGCSA-N
XLogP1.23
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide?
The IUPAC name of N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide (CID 164635280) is N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide.
What is the SMILES notation for N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide?
The canonical SMILES for N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide is COc1cc(C(=O)NC[C@H]2CCCCN2C2CC2)ncn1.
What is the InChIKey of N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide?
The InChIKey is WDHZYFGGLBVKQU-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-21-14-8-13(17-10-18-14)15(20)16-9-12-4-2-3-7-19(12)11-5-6-11/h8,10-12H,2-7,9H2,1H3,(H,16,20)/t12-/m1/s1.
What are the key properties of N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide?
N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide is sourced from PubChem (CID 164635280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).