N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine

C9H12N4O — CID 79495336

IUPACN-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine
SMILESCc1[nH]ncc1CNCc1ccon1
InChIInChI=1S/C9H12N4O/c1-7-8(5-11-12-7)4-10-6-9-2-3-14-13-9/h2-3,5,10H,4,6H2,1H3,(H,11,12)
InChIKeyYUTPXSPWFBIFQJ-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.00
Rot. Bonds4

About N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine (PubChem CID 79495336) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine.

Molecular Properties

Compound NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine
PubChem CID79495336
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine
SMILESCc1[nH]ncc1CNCc1ccon1
InChIInChI=1S/C9H12N4O/c1-7-8(5-11-12-7)4-10-6-9-2-3-14-13-9/h2-3,5,10H,4,6H2,1H3,(H,11,12)
InChIKeyYUTPXSPWFBIFQJ-UHFFFAOYSA-N
XLogP1.00
TPSA66.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-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-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(5-methylthiophen-2-yl)methanamine
CID 60761461
N-[(2,5-dimethylfuran-3-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine
CID 115876673
N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine
CID 81170570
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 86776389
2-[5-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]thiophen-2-yl]acetic acid
CID 82894868
N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine
CID 107911776
1-[4-(methoxymethyl)phenyl]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]methanamine;hydrochloride
CID 86808500
5-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]furan-2-carboxylic acid
CID 63317797
1-(3,4-dimethoxyphenyl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]methanamine
CID 43435343
1-(1-ethylpyrrol-3-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]methanamine
CID 66415561
1-(2-ethyl-1,3-thiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]methanamine
CID 61004647
6-methyl-2-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]pyridin-3-ol
CID 79032588

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine?
The IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine (CID 79495336) is N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine.
What is the SMILES notation for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine?
The canonical SMILES for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine is Cc1[nH]ncc1CNCc1ccon1.
What is the InChIKey of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine?
The InChIKey is YUTPXSPWFBIFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c1-7-8(5-11-12-7)4-10-6-9-2-3-14-13-9/h2-3,5,10H,4,6H2,1H3,(H,11,12).
What are the key properties of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine?
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine has a molecular weight of 192.22 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(1,2-oxazol-3-yl)methanamine is sourced from PubChem (CID 79495336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).