2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide

C18H25N5O2 — CID 118765444

IUPAC2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide
SMILESCc1nc2ncccn2c1C(=O)NC1CCN(C2CCOCC2)CC1
InChIInChI=1S/C18H25N5O2/c1-13-16(23-8-2-7-19-18(23)20-13)17(24)21-14-3-9-22(10-4-14)15-5-11-25-12-6-15/h2,7-8,14-15H,3-6,9-12H2,1H3,(H,21,24)
InChIKeyYNNXOORYFZZKLP-UHFFFAOYSA-N
MW343.43 g/mol
LogP1.41
Rot. Bonds3

About 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide

2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide (PubChem CID 118765444) has the molecular formula C18H25N5O2 and a molecular weight of 343.43 g/mol. Its IUPAC name is 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide
PubChem CID118765444
Molecular FormulaC18H25N5O2
Molecular Weight343.43 g/mol
Exact Mass343.20
IUPAC Name2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide
SMILESCc1nc2ncccn2c1C(=O)NC1CCN(C2CCOCC2)CC1
InChIInChI=1S/C18H25N5O2/c1-13-16(23-8-2-7-19-18(23)20-13)17(24)21-14-3-9-22(10-4-14)15-5-11-25-12-6-15/h2,7-8,14-15H,3-6,9-12H2,1H3,(H,21,24)
InChIKeyYNNXOORYFZZKLP-UHFFFAOYSA-N
XLogP1.41
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,6-dimethyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 118775631
2-chloro-6-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]benzamide
CID 118774564
3-ethyl-N-[1-(oxan-4-yl)piperidin-4-yl]-1,2,4-oxadiazole-5-carboxamide
CID 136569802
3-amino-N-(1-cyclopropylpiperidin-4-yl)pyridine-2-carboxamide
CID 104741372
3-chloro-N-[1-(oxan-4-yl)piperidin-4-yl]benzamide
CID 126834663
4-(2-fluoro-6-methylphenyl)-N-[1-(oxan-4-yl)piperidin-4-yl]-1H-pyrazole-5-carboxamide
CID 142995019
4-(2-methyltetrazol-5-yl)-N-[1-(oxan-4-yl)piperidin-4-yl]benzamide
CID 118793021
2-chloro-N-(1-cyclopropylpiperidin-4-yl)pyridine-3-carboxamide
CID 60728134
2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 118454719
N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide
CID 28906722
oxalic acid;N-[1-(oxan-4-yl)piperidin-4-yl]-1-propan-2-ylindazole-3-carboxamide
CID 171354359
N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide
CID 39974888

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide (CID 118765444) is 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide is Cc1nc2ncccn2c1C(=O)NC1CCN(C2CCOCC2)CC1.
What is the InChIKey of 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is YNNXOORYFZZKLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O2/c1-13-16(23-8-2-7-19-18(23)20-13)17(24)21-14-3-9-22(10-4-14)15-5-11-25-12-6-15/h2,7-8,14-15H,3-6,9-12H2,1H3,(H,21,24).
What are the key properties of 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide?
2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(oxan-4-yl)piperidin-4-yl]imidazo[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 118765444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).