N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine

C13H21N3O — CID 126549493

IUPACN-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
SMILESCN1CCC(N(Cc2ccon2)C2CC2)CC1
InChIInChI=1S/C13H21N3O/c1-15-7-4-13(5-8-15)16(12-2-3-12)10-11-6-9-17-14-11/h6,9,12-13H,2-5,7-8,10H2,1H3
InChIKeyXMDRPSPWKSKOFD-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.73
Rot. Bonds4

About N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine

N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine (PubChem CID 126549493) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
PubChem CID126549493
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
SMILESCN1CCC(N(Cc2ccon2)C2CC2)CC1
InChIInChI=1S/C13H21N3O/c1-15-7-4-13(5-8-15)16(12-2-3-12)10-11-6-9-17-14-11/h6,9,12-13H,2-5,7-8,10H2,1H3
InChIKeyXMDRPSPWKSKOFD-UHFFFAOYSA-N
XLogP1.73
TPSA32.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine;hydrochloride
CID 126511816
tert-butyl 4-[cyclopropyl(1,2-oxazol-3-ylmethyl)amino]piperidine-1-carboxylate
CID 126511766
3-[2-(4-methylpiperazin-1-yl)ethyl]-1,2-oxazole
CID 142367397
ethane;3-[6-(4-methylpiperazin-1-yl)hexyl]-1,2-oxazole
CID 142386109
N'-methyl-N'-(1,2-oxazol-3-ylmethyl)ethane-1,2-diamine
CID 115869778
ethane;3-[4-(4-methylpiperazin-1-yl)butoxymethyl]-1,2-oxazole
CID 142390718
N-methyl-N-(1,2-oxazol-3-ylmethyl)sulfamoyl chloride
CID 165491085
N-methyl-N-(1,2-oxazol-3-ylmethyl)acetamide
CID 58166119
N-methyl-N-(1,2-oxazol-3-ylmethyl)-1-(5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-amine
CID 126919780
N-[[2-(aminomethyl)-4-pyridinyl]methyl]-N,1-dimethylpiperidin-4-amine
CID 63886661
N-[[3-(aminomethyl)furan-2-yl]methyl]-N,1-dimethylpiperidin-4-amine
CID 62424649
N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
CID 81178472

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The IUPAC name of N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine (CID 126549493) is N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The canonical SMILES for N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine is CN1CCC(N(Cc2ccon2)C2CC2)CC1.
What is the InChIKey of N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The InChIKey is XMDRPSPWKSKOFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-15-7-4-13(5-8-15)16(12-2-3-12)10-11-6-9-17-14-11/h6,9,12-13H,2-5,7-8,10H2,1H3.
What are the key properties of N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine has a molecular weight of 235.33 g/mol, XLogP of 1.73, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-methyl-N-(1,2-oxazol-3-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 126549493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).