4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide

C15H24N4O2 — CID 47865683

IUPAC4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide
SMILESCc1noc(C)c1CNC(=O)N1CCN(CC2CC2)CC1
InChIInChI=1S/C15H24N4O2/c1-11-14(12(2)21-17-11)9-16-15(20)19-7-5-18(6-8-19)10-13-3-4-13/h13H,3-10H2,1-2H3,(H,16,20)
InChIKeyOCLUNLGIRQMMNS-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.53
Rot. Bonds4

About 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide

4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide (PubChem CID 47865683) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide
PubChem CID47865683
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide
SMILESCc1noc(C)c1CNC(=O)N1CCN(CC2CC2)CC1
InChIInChI=1S/C15H24N4O2/c1-11-14(12(2)21-17-11)9-16-15(20)19-7-5-18(6-8-19)10-13-3-4-13/h13H,3-10H2,1-2H3,(H,16,20)
InChIKeyOCLUNLGIRQMMNS-UHFFFAOYSA-N
XLogP1.53
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 9506625
9-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 3233221
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-ethyl-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 9465685
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3,5-dimethyl-N-(3-methylbutyl)-1,2-oxazole-4-carboxamide
CID 24686840
1-[(Dimethyl-1,2-oxazol-4-yl)methyl]piperazine
CID 2772401
1-((Dimethyl-1,2-oxazol-4-yl)methyl)piperazine dihydrochloride
CID 42933684
(5R)-9-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-propan-2-yl-2,9-diazaspiro[4.5]decane-2-carboxamide
CID 3233416
9-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-propan-2-yl-2,9-diazaspiro[5.5]undecane-2-carboxamide
CID 3234297
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 24687252
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-propylpiperazine-1-carboxamide
CID 47278907
1-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-1-methyl-3-(1-methylsulfonylpiperidin-3-yl)urea
CID 47766190
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-(hydroxymethyl)piperidine-1-carboxamide
CID 47861982

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide?
The IUPAC name of 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide (CID 47865683) is 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide?
The canonical SMILES for 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide is Cc1noc(C)c1CNC(=O)N1CCN(CC2CC2)CC1.
What is the InChIKey of 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide?
The InChIKey is OCLUNLGIRQMMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-11-14(12(2)21-17-11)9-16-15(20)19-7-5-18(6-8-19)10-13-3-4-13/h13H,3-10H2,1-2H3,(H,16,20).
What are the key properties of 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide?
4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carboxamide is sourced from PubChem (CID 47865683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).