[1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone

C14H24N4O2 — CID 104957671

IUPAC[1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone
SMILESCc1c(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cnn1CCCN
InChIInChI=1S/C14H24N4O2/c1-10-8-17(9-11(2)20-10)14(19)13-7-16-18(12(13)3)6-4-5-15/h7,10-11H,4-6,8-9,15H2,1-3H3/t10-,11+
InChIKeyMQGHXFNFMSFIST-PHIMTYICSA-N
MW280.37 g/mol
LogP0.79
Rot. Bonds4

About [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone

[1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone (PubChem CID 104957671) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name[1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone
PubChem CID104957671
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name[1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone
SMILESCc1c(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cnn1CCCN
InChIInChI=1S/C14H24N4O2/c1-10-8-17(9-11(2)20-10)14(19)13-7-16-18(12(13)3)6-4-5-15/h7,10-11H,4-6,8-9,15H2,1-3H3/t10-,11+
InChIKeyMQGHXFNFMSFIST-PHIMTYICSA-N
XLogP0.79
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone 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

6-Methyl-2-[5-methyl-4-(4-morpholinylcarbonyl)-1h-pyrazol-1-yl]-4(3h)-pyrimidinone
CID 137049221
N-(3-ethoxypropyl)-1-ethyl-3-methylpyrazole-4-carboxamide
CID 19474450
N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-1,5-dimethylpyrazole-4-carboxamide
CID 47028290
1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)carbonyl]-4-(tetrahydrofuran-2-ylmethyl)piperazine
CID 50979496
1,5-dimethyl-N,N-dipropylpyrazole-4-carboxamide
CID 51076097
N,N-bis(2-methoxyethyl)-1,5-dimethylpyrazole-4-carboxamide
CID 51076099
5-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrazole-4-carboxamide
CID 61684995
5-methyl-1-propyl-N-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1H-pyrazole-4-carboxamide
CID 72884873
5-methyl-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]-1-propylpyrazole-4-carboxamide
CID 72929946
N,1,3-trimethyl-N-(1-methylpiperidin-4-yl)pyrazole-4-carboxamide
CID 42352823
2-(4-methylpentyl)-4-[(5-methyl-1-propyl-1H-pyrazol-4-yl)carbonyl]morpholine
CID 45202125
N-[(3-hydroxy-3-piperidinyl)methyl]-5-methyl-1-propyl-1H-pyrazole-4-carboxamide
CID 72847093

Frequently Asked Questions

What is the IUPAC name of [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone?
The IUPAC name of [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone (CID 104957671) is [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone.
What is the SMILES notation for [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone?
The canonical SMILES for [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone is Cc1c(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cnn1CCCN.
What is the InChIKey of [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone?
The InChIKey is MQGHXFNFMSFIST-PHIMTYICSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-10-8-17(9-11(2)20-10)14(19)13-7-16-18(12(13)3)6-4-5-15/h7,10-11H,4-6,8-9,15H2,1-3H3/t10-,11+.
What are the key properties of [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone?
[1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone has a molecular weight of 280.37 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-aminopropyl)-5-methylpyrazol-4-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone is sourced from PubChem (CID 104957671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).