N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide

C15H23N3O2 — CID 46744262

IUPACN-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide
SMILESCC1CCN(Cc2nc(C(=O)NCC3CC3)co2)CC1
InChIInChI=1S/C15H23N3O2/c1-11-4-6-18(7-5-11)9-14-17-13(10-20-14)15(19)16-8-12-2-3-12/h10-12H,2-9H2,1H3,(H,16,19)
InChIKeyNXXGQDPPQNOHFM-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.05
Rot. Bonds5

About N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide

N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide (PubChem CID 46744262) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide
PubChem CID46744262
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide
SMILESCC1CCN(Cc2nc(C(=O)NCC3CC3)co2)CC1
InChIInChI=1S/C15H23N3O2/c1-11-4-6-18(7-5-11)9-14-17-13(10-20-14)15(19)16-8-12-2-3-12/h10-12H,2-9H2,1H3,(H,16,19)
InChIKeyNXXGQDPPQNOHFM-UHFFFAOYSA-N
XLogP2.05
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-Isopropyl-piperazin-1-yl)-{2-[(2-methoxy-ethylamino)-methyl]-oxazol-4-yl}-methanone
CID 11638162
(4-Isopropyl-piperazin-1-yl)-(2-piperidin-1-ylmethyloxazol-4-yl)-methanone
CID 11716742
N,N-dicyclohexyl-2-cyclopropyl-1,3-oxazole-4-carboxamide
CID 25110521
4-(2-Methyloxazoyl)-Cha-Ile-NH2
CID 49788155
2-[(4-methylpiperidin-1-yl)methyl]-N-propan-2-yl-1,3-oxazole-4-carboxamide
CID 42656529
N-cyclohexyl-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide
CID 91633762
4-(Methoxymethyl)-N-methyl-1-(2-methyl-1,3-oxazole-4-carbonyl)pyrrolidine-3-carboxamide
CID 124051985
2-methyl-N-[2-(4-morpholinyl)ethyl]-1,3-oxazole-4-carboxamide
CID 30403029
2-methyl-N-pentan-2-yl-1,3-oxazole-4-carboxamide
CID 43906526
(2R)-2-[[formyl(hydroxy)amino]methyl]-N-[(1S)-2-methyl-1-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]propyl]hexanamide
CID 66551453
3-[(2-Methyl-1,3-oxazol-4-YL)methyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 72889765
2-ethyl-N-(4-ethylcyclohexyl)-N-methyl-1,3-oxazole-4-carboxamide
CID 75455119

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide (CID 46744262) is N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide is CC1CCN(Cc2nc(C(=O)NCC3CC3)co2)CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is NXXGQDPPQNOHFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-11-4-6-18(7-5-11)9-14-17-13(10-20-14)15(19)16-8-12-2-3-12/h10-12H,2-9H2,1H3,(H,16,19).
What are the key properties of N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide?
N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[(4-methylpiperidin-1-yl)methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 46744262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).