N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide

C11H17N3O2 — CID 106607279

IUPACN,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide
SMILESCc1cnoc1C(=O)N(C)CC1CCCN1
InChIInChI=1S/C11H17N3O2/c1-8-6-13-16-10(8)11(15)14(2)7-9-4-3-5-12-9/h6,9,12H,3-5,7H2,1-2H3
InChIKeyQQSFZYWAPBCOJT-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.81
Rot. Bonds3

About N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide

N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide (PubChem CID 106607279) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide
PubChem CID106607279
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide
SMILESCc1cnoc1C(=O)N(C)CC1CCCN1
InChIInChI=1S/C11H17N3O2/c1-8-6-13-16-10(8)11(15)14(2)7-9-4-3-5-12-9/h6,9,12H,3-5,7H2,1-2H3
InChIKeyQQSFZYWAPBCOJT-UHFFFAOYSA-N
XLogP0.81
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-hydroxycyclobutyl)methyl]-N,4-dimethyl-1,2-oxazole-5-carboxamide
CID 66334957
N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-imidazole-5-carboxamide
CID 106607277
N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 106607470
N-methyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 106607345
N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-2-carboxamide
CID 106607724
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]pyrazine-2-carboxamide
CID 97164269
2-bromo-N,5-dimethyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607476
N,5-dimethyl-N-(piperidin-2-ylmethyl)-1,2,4-oxadiazole-3-carboxamide
CID 106627465
3,5-dichloro-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607655
N-methyl-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide
CID 106607527
4-bromo-N,2-dimethyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608037
2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608014

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide (CID 106607279) is N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide is Cc1cnoc1C(=O)N(C)CC1CCCN1.
What is the InChIKey of N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide?
The InChIKey is QQSFZYWAPBCOJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8-6-13-16-10(8)11(15)14(2)7-9-4-3-5-12-9/h6,9,12H,3-5,7H2,1-2H3.
What are the key properties of N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide?
N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 106607279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).