6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide

C19H27N5O4 — CID 162376564

IUPAC6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide
SMILESNC(=O)c1cc(N2CCC(C(=O)N3OCCC3C3CCCOC3)CC2)ncn1
InChIInChI=1S/C19H27N5O4/c20-18(25)15-10-17(22-12-21-15)23-6-3-13(4-7-23)19(26)24-16(5-9-28-24)14-2-1-8-27-11-14/h10,12-14,16H,1-9,11H2,(H2,20,25)
InChIKeyVNTUVZVRSNNRPO-UHFFFAOYSA-N
MW389.46 g/mol
LogP0.75
Rot. Bonds4

About 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide

6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide (PubChem CID 162376564) has the molecular formula C19H27N5O4 and a molecular weight of 389.46 g/mol. Its IUPAC name is 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide
PubChem CID162376564
Molecular FormulaC19H27N5O4
Molecular Weight389.46 g/mol
Exact Mass389.21
IUPAC Name6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide
SMILESNC(=O)c1cc(N2CCC(C(=O)N3OCCC3C3CCCOC3)CC2)ncn1
InChIInChI=1S/C19H27N5O4/c20-18(25)15-10-17(22-12-21-15)23-6-3-13(4-7-23)19(26)24-16(5-9-28-24)14-2-1-8-27-11-14/h10,12-14,16H,1-9,11H2,(H2,20,25)
InChIKeyVNTUVZVRSNNRPO-UHFFFAOYSA-N
XLogP0.75
TPSA110.88 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[4-[(3S)-3-(5-fluoro-2H-pyrimidin-1-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide
CID 154697979
6-[4-[3-(Oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide;2,2,2-trifluoroacetic acid
CID 175877384
2-[4-[(3S)-3-pyrimidin-5-yl-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide
CID 162376397
2-[4-[3-(Oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide
CID 162376645
Ethyl 1-(6-(pyrrolidin-1-yl)pyrimidine-4-carbonyl)piperidine-3-carboxylate
CID 92104170
[(4aS,8R,8aS)-8-pyrrolidin-1-yl-2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyridin-6-yl]-pyrimidin-4-ylmethanone
CID 98810862
N-(1-oxaspiro[5.5]undecan-4-yl)-6-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 126839302
N-[4-(hydroxymethyl)cyclohexyl]-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 126840367
8-Oxa-2-azaspiro[4.5]decan-2-yl-(6-piperidin-1-ylpyrimidin-4-yl)methanone
CID 137978322
[(3aR,6aS)-1'-methylspiro[3a,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrole-3,4'-piperidine]-1-yl]-(6-morpholin-4-ylpyrimidin-4-yl)methanone
CID 138015779
2-Oxa-9-azaspiro[4.5]decan-9-yl-(6-piperidin-1-ylpyrimidin-4-yl)methanone
CID 138036746
[(3aR,7aS)-3,3a,4,6,7,7a-hexahydro-2H-furo[3,2-c]pyridin-5-yl]-(6-piperidin-1-ylpyrimidin-4-yl)methanone
CID 139020805

Frequently Asked Questions

What is the IUPAC name of 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide?
The IUPAC name of 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide (CID 162376564) is 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide.
What is the SMILES notation for 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide?
The canonical SMILES for 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide is NC(=O)c1cc(N2CCC(C(=O)N3OCCC3C3CCCOC3)CC2)ncn1.
What is the InChIKey of 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide?
The InChIKey is VNTUVZVRSNNRPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O4/c20-18(25)15-10-17(22-12-21-15)23-6-3-13(4-7-23)19(26)24-16(5-9-28-24)14-2-1-8-27-11-14/h10,12-14,16H,1-9,11H2,(H2,20,25).
What are the key properties of 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide?
6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[3-(oxan-3-yl)-1,2-oxazolidine-2-carbonyl]piperidin-1-yl]pyrimidine-4-carboxamide is sourced from PubChem (CID 162376564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).