N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide

C16H24N2O3 — CID 127893601

IUPACN-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1coc(C2CCOCC2)n1
InChIInChI=1S/C16H24N2O3/c1-2-7-18(10-12-3-4-12)16(19)14-11-21-15(17-14)13-5-8-20-9-6-13/h11-13H,2-10H2,1H3
InChIKeyJBHMQVAFVQGNER-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.83
Rot. Bonds6

About N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide

N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide (PubChem CID 127893601) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide
PubChem CID127893601
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1coc(C2CCOCC2)n1
InChIInChI=1S/C16H24N2O3/c1-2-7-18(10-12-3-4-12)16(19)14-11-21-15(17-14)13-5-8-20-9-6-13/h11-13H,2-10H2,1H3
InChIKeyJBHMQVAFVQGNER-UHFFFAOYSA-N
XLogP2.83
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopropylmethyl)-N-propylfuran-3-carboxamide
CID 86912308
2-(2-aminoethyl)-N-(cyclopropylmethyl)-N-propyl-1,3-thiazole-4-carboxamide;hydrochloride
CID 120616809
N-(cyclopropylmethyl)-N-propyl-1-benzofuran-3-carboxamide
CID 77086659
N-(cyclopropylmethyl)-5-(methylamino)-N-propylpyrazine-2-carboxamide
CID 107374841
2-[2-(oxan-4-yl)-1,3-oxazol-4-yl]acetic acid
CID 115027242
N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374839
(2,2-dimethyl-3H-1,4-benzoxazin-4-yl)-[2-(oxan-4-yl)-1,3-oxazol-4-yl]methanone
CID 127907878
N-(cyclopropylmethyl)-N-propylacetamide
CID 59001159
2-(oxan-4-yl)-N-(1H-pyrazol-4-yl)-1,3-oxazole-4-carboxamide
CID 127905949
2-amino-6-chloro-N-(cyclopropylmethyl)-N-propylpyridine-4-carboxamide
CID 55041470
4-amino-N-(cyclopropylmethyl)-N-propyloxane-4-carboxamide
CID 115293756
2-amino-N-(cyclopropylmethyl)-N-propylbenzamide
CID 22493330

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide (CID 127893601) is N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide is CCCN(CC1CC1)C(=O)c1coc(C2CCOCC2)n1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide?
The InChIKey is JBHMQVAFVQGNER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-2-7-18(10-12-3-4-12)16(19)14-11-21-15(17-14)13-5-8-20-9-6-13/h11-13H,2-10H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide?
N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 2.83, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(oxan-4-yl)-N-propyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 127893601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).