N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine

C13H23N3O — CID 115085597

IUPACN-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine
SMILESCNCc1cnc(C2CCCN(C(C)C)C2)o1
InChIInChI=1S/C13H23N3O/c1-10(2)16-6-4-5-11(9-16)13-15-8-12(17-13)7-14-3/h8,10-11,14H,4-7,9H2,1-3H3
InChIKeyWJANLISNQQUXKZ-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.98
Rot. Bonds4

About N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine

N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine (PubChem CID 115085597) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine
PubChem CID115085597
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC NameN-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine
SMILESCNCc1cnc(C2CCCN(C(C)C)C2)o1
InChIInChI=1S/C13H23N3O/c1-10(2)16-6-4-5-11(9-16)13-15-8-12(17-13)7-14-3/h8,10-11,14H,4-7,9H2,1-3H3
InChIKeyWJANLISNQQUXKZ-UHFFFAOYSA-N
XLogP1.98
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine 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-methyl-2-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]ethanamine
CID 115085620
[2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazol-5-yl]methanamine
CID 115084985
1-[2-(1-ethylpiperidin-3-yl)-1,3-oxazol-5-yl]-N-methylpropan-2-amine
CID 115085623
1-[2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazol-5-yl]ethanamine
CID 115084987
N-methyl-1-[3-(1-propan-2-ylpiperidin-3-yl)-1,2,4-oxadiazol-5-yl]methanamine
CID 115081078
N-methyl-1-[2-[(1-propan-2-ylpiperidin-3-yl)methyl]-1,3-thiazol-5-yl]methanamine
CID 115091144
1-[2-(1,1-dioxothiolan-3-yl)-1,3-oxazol-5-yl]-N-methylmethanamine
CID 115084990
N-methyl-1-[2-(1-methylpyrrolidin-3-yl)-1,3-oxazol-5-yl]propan-2-amine
CID 115085018
N-methyl-1-[2-(oxan-2-yl)-1,3-oxazol-5-yl]methanamine
CID 115085883
N-methyl-1-[2-[(1-propan-2-ylpiperidin-3-yl)methyl]-1,3-oxazol-5-yl]propan-2-amine
CID 115086399
2-[2-(1-ethylpiperidin-3-yl)-1,3-oxazol-5-yl]acetic acid
CID 115085641
N-methyl-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-amine
CID 124964857

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine?
The IUPAC name of N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine (CID 115085597) is N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine is CNCc1cnc(C2CCCN(C(C)C)C2)o1.
What is the InChIKey of N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine?
The InChIKey is WJANLISNQQUXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-10(2)16-6-4-5-11(9-16)13-15-8-12(17-13)7-14-3/h8,10-11,14H,4-7,9H2,1-3H3.
What are the key properties of N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine?
N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine has a molecular weight of 237.35 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazol-5-yl]methanamine is sourced from PubChem (CID 115085597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).