(2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide

C15H22N4O2 — CID 129490037

IUPAC(2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESCc1cc(N2CCC([C@H](O)C(=O)NC3CC3)CC2)ncn1
InChIInChI=1S/C15H22N4O2/c1-10-8-13(17-9-16-10)19-6-4-11(5-7-19)14(20)15(21)18-12-2-3-12/h8-9,11-12,14,20H,2-7H2,1H3,(H,18,21)/t14-/m0/s1
InChIKeyNHXHTFQJDQKEKG-AWEZNQCLSA-N
MW290.37 g/mol
LogP0.64
Rot. Bonds4

About (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide

(2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide (PubChem CID 129490037) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name(2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide
PubChem CID129490037
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name(2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESCc1cc(N2CCC([C@H](O)C(=O)NC3CC3)CC2)ncn1
InChIInChI=1S/C15H22N4O2/c1-10-8-13(17-9-16-10)19-6-4-11(5-7-19)14(20)15(21)18-12-2-3-12/h8-9,11-12,14,20H,2-7H2,1H3,(H,18,21)/t14-/m0/s1
InChIKeyNHXHTFQJDQKEKG-AWEZNQCLSA-N
XLogP0.64
TPSA78.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]acetamide
CID 129489839
N-cyclopropyl-2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-oxoacetamide
CID 133297271
(2S)-N-cyclopropyl-2-hydroxy-2-[1-(4-methylpyrimidin-2-yl)piperidin-4-yl]acetamide
CID 129489968
N-cyclopentyl-4-(6-methylpyrimidin-4-yl)piperazine-1-carboxamide
CID 71795117
(2R)-N-cyclopropyl-2-hydroxy-2-[1-(8-methylquinazolin-4-yl)piperidin-4-yl]acetamide
CID 129489930
N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]thiophene-3-carboxamide
CID 133298747
4-(4-chloropiperidin-1-yl)-6-methylpyrimidine
CID 63388301
N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide
CID 133305493
[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]methanol
CID 61225123
3-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]propanoic acid
CID 62218201
(3S)-N,N-dimethyl-1-(6-methylpyrimidin-4-yl)pyrrolidine-3-carboxamide
CID 95839551
(3R)-N,N-dimethyl-1-(6-methylpyrimidin-4-yl)pyrrolidine-3-carboxamide
CID 95839552

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The IUPAC name of (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide (CID 129490037) is (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide.
What is the SMILES notation for (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The canonical SMILES for (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide is Cc1cc(N2CCC([C@H](O)C(=O)NC3CC3)CC2)ncn1.
What is the InChIKey of (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The InChIKey is NHXHTFQJDQKEKG-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-10-8-13(17-9-16-10)19-6-4-11(5-7-19)14(20)15(21)18-12-2-3-12/h8-9,11-12,14,20H,2-7H2,1H3,(H,18,21)/t14-/m0/s1.
What are the key properties of (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide?
(2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide has a molecular weight of 290.37 g/mol, XLogP of 0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopropyl-2-hydroxy-2-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide is sourced from PubChem (CID 129490037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).