N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide

C17H29N3O2 — CID 97189300

IUPACN-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide
SMILESCC(C)c1cc(CN(C)C(=O)CC[C@H]2CCCCN2C)no1
InChIInChI=1S/C17H29N3O2/c1-13(2)16-11-14(18-22-16)12-20(4)17(21)9-8-15-7-5-6-10-19(15)3/h11,13,15H,5-10,12H2,1-4H3/t15-/m1/s1
InChIKeySXSGXCZPKXDDLF-OAHLLOKOSA-N
MW307.44 g/mol
LogP3.02
Rot. Bonds6

About N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide

N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide (PubChem CID 97189300) has the molecular formula C17H29N3O2 and a molecular weight of 307.44 g/mol. Its IUPAC name is N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide.

Molecular Properties

Compound NameN-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide
PubChem CID97189300
Molecular FormulaC17H29N3O2
Molecular Weight307.44 g/mol
Exact Mass307.23
IUPAC NameN-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide
SMILESCC(C)c1cc(CN(C)C(=O)CC[C@H]2CCCCN2C)no1
InChIInChI=1S/C17H29N3O2/c1-13(2)16-11-14(18-22-16)12-20(4)17(21)9-8-15-7-5-6-10-19(15)3/h11,13,15H,5-10,12H2,1-4H3/t15-/m1/s1
InChIKeySXSGXCZPKXDDLF-OAHLLOKOSA-N
XLogP3.02
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-3-(1-methylpiperidin-2-yl)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]propanamide
CID 50956753
N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2S)-1-methylpiperidin-2-yl]propanamide
CID 97191951
3-cyclopentyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide
CID 51077919
(3R)-N-methyl-1-(oxan-4-yl)-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]piperidine-3-carboxamide
CID 125176171
N-methyl-3-(1-methylpiperidin-2-yl)-N-[2-(1H-pyrazol-4-yl)ethyl]propanamide
CID 50967172
N-methyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
CID 91835204
3-(1-cyclopentyl-4-methylpyrazol-5-yl)-1-methyl-1-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]urea
CID 74238195
3-[(2R)-1-methylpiperidin-2-yl]-1-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-1-one
CID 95136927
N-[2-(6-chloro-1H-benzimidazol-2-yl)ethyl]-N-methyl-3-[(2S)-1-methylpiperidin-2-yl]propanamide
CID 97197890
N-[2-(6-fluoro-1H-benzimidazol-2-yl)ethyl]-N-methyl-3-[(2S)-1-methylpiperidin-2-yl]propanamide
CID 95204074
N,N-dimethyl-1-(5-propan-2-yl-1,2-oxazol-3-yl)methanamine
CID 126550901
N-(2-hydroxyethyl)-3-[(2R)-1-methylpiperidin-2-yl]-N-(1,3-thiazol-2-ylmethyl)propanamide
CID 97197758

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide?
The IUPAC name of N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide (CID 97189300) is N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide.
What is the SMILES notation for N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide?
The canonical SMILES for N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide is CC(C)c1cc(CN(C)C(=O)CC[C@H]2CCCCN2C)no1.
What is the InChIKey of N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide?
The InChIKey is SXSGXCZPKXDDLF-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H29N3O2/c1-13(2)16-11-14(18-22-16)12-20(4)17(21)9-8-15-7-5-6-10-19(15)3/h11,13,15H,5-10,12H2,1-4H3/t15-/m1/s1.
What are the key properties of N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide?
N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide has a molecular weight of 307.44 g/mol, XLogP of 3.02, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[(2R)-1-methylpiperidin-2-yl]-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide is sourced from PubChem (CID 97189300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).