5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide

C11H17N5O3 — CID 67077482

IUPAC5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide
SMILESCc1nc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)o1
InChIInChI=1S/C11H17N5O3/c1-6-14-8(10(19-6)16-11(12)18)9(17)15-7-3-2-4-13-5-7/h7,13H,2-5H2,1H3,(H,15,17)(H3,12,16,18)/t7-/m0/s1
InChIKeyDBYUDINEBGVYEV-ZETCQYMHSA-N
MW267.29 g/mol
LogP-0.04
Rot. Bonds3

About 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide

5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide (PubChem CID 67077482) has the molecular formula C11H17N5O3 and a molecular weight of 267.29 g/mol. Its IUPAC name is 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide
PubChem CID67077482
Molecular FormulaC11H17N5O3
Molecular Weight267.29 g/mol
Exact Mass267.13
IUPAC Name5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide
SMILESCc1nc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)o1
InChIInChI=1S/C11H17N5O3/c1-6-14-8(10(19-6)16-11(12)18)9(17)15-7-3-2-4-13-5-7/h7,13H,2-5H2,1H3,(H,15,17)(H3,12,16,18)/t7-/m0/s1
InChIKeyDBYUDINEBGVYEV-ZETCQYMHSA-N
XLogP-0.04
TPSA122.28 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 5-0.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-dimethyl-N-pyrrolidin-3-yl-1,3-oxazole-5-carboxamide
CID 81478965
4-methyl-N-piperidin-3-yl-1,3-oxazole-5-carboxamide
CID 81471254
3-amino-6-methyl-5-(1,3-oxazol-2-yl)-N-piperidin-3-ylpyrazine-2-carboxamide
CID 121351206
5-methyl-N-piperidin-3-ylfuran-2-carboxamide
CID 43603726
2,3,4,5,6-pentafluoro-N-[(3S)-piperidin-3-yl]benzamide
CID 104982388
2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide
CID 93274596
4-methyl-N-[(3S)-piperidin-3-yl]thiadiazole-5-carboxamide
CID 104982433
2,5-dimethyl-N-piperidin-3-ylfuran-3-carboxamide;hydrochloride
CID 119427545
2,4-dimethyl-N-piperidin-3-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119425598
5-ethyl-N-[(3S)-piperidin-3-yl]-1H-1,2,4-triazole-3-carboxamide
CID 104982379
4-amino-2-(methylamino)-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-carboxamide
CID 45107290
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-piperidin-3-yltriazole-4-carboxamide
CID 119424625

Frequently Asked Questions

What is the IUPAC name of 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide (CID 67077482) is 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide is Cc1nc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)o1.
What is the InChIKey of 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide?
The InChIKey is DBYUDINEBGVYEV-ZETCQYMHSA-N. The full InChI is InChI=1S/C11H17N5O3/c1-6-14-8(10(19-6)16-11(12)18)9(17)15-7-3-2-4-13-5-7/h7,13H,2-5H2,1H3,(H,15,17)(H3,12,16,18)/t7-/m0/s1.
What are the key properties of 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide?
5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of -0.04, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(carbamoylamino)-2-methyl-N-[(3S)-piperidin-3-yl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 67077482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).