N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine

C14H20N6O — CID 56817472

IUPACN-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine
SMILESc1cnn(CCNCc2cnc(N3CCOCC3)nc2)c1
InChIInChI=1S/C14H20N6O/c1-2-18-20(4-1)5-3-15-10-13-11-16-14(17-12-13)19-6-8-21-9-7-19/h1-2,4,11-12,15H,3,5-10H2
InChIKeyHQSCXHXQKWPPPK-UHFFFAOYSA-N
MW288.35 g/mol
LogP0.30
Rot. Bonds6

About N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine

N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine (PubChem CID 56817472) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine.

Molecular Properties

Compound NameN-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine
PubChem CID56817472
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC NameN-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine
SMILESc1cnn(CCNCc2cnc(N3CCOCC3)nc2)c1
InChIInChI=1S/C14H20N6O/c1-2-18-20(4-1)5-3-15-10-13-11-16-14(17-12-13)19-6-8-21-9-7-19/h1-2,4,11-12,15H,3,5-10H2
InChIKeyHQSCXHXQKWPPPK-UHFFFAOYSA-N
XLogP0.30
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine 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

2,4-di(morpholin-4-yl)-6-(1H-pyrazol-1-yl)-1,3,5-triazine
CID 738196
4-(6-Pyrazol-1-ylpyrimidin-4-yl)morpholine
CID 661544
2-pyrazol-1-yl-N-[(2-pyrrolidin-1-ylpyrimidin-5-yl)methyl]ethanamine
CID 56817471
2-[2-(4-Methylpyrazol-1-yl)ethylamino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 72142066
(4aR,7aS)-6-[(1-methylpyrazol-4-yl)methyl]-4-pyrimidin-2-yl-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazine
CID 97377521
[2-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]amine
CID 33677352
N-(3-morpholin-4-ylpropyl)-6-pyrazol-1-ylpyrazin-2-amine
CID 53501085
N-{2-[4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]ethyl}pyrimidin-2-amine
CID 72904896
(2S)-1-(4-methylpyrazol-1-yl)-N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]propan-2-amine
CID 95290649
N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine
CID 129320707
(2S)-N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-2-pyrazol-1-ylpropanamide
CID 129523291
N,N-dimethyl-4-[(2R)-2-(pyrazol-1-ylmethyl)morpholin-4-yl]pyrimidin-2-amine
CID 164639660

Frequently Asked Questions

What is the IUPAC name of N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine?
The IUPAC name of N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine (CID 56817472) is N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine.
What is the SMILES notation for N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine?
The canonical SMILES for N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine is c1cnn(CCNCc2cnc(N3CCOCC3)nc2)c1.
What is the InChIKey of N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine?
The InChIKey is HQSCXHXQKWPPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-2-18-20(4-1)5-3-15-10-13-11-16-14(17-12-13)19-6-8-21-9-7-19/h1-2,4,11-12,15H,3,5-10H2.
What are the key properties of N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine?
N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine has a molecular weight of 288.35 g/mol, XLogP of 0.30, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine is sourced from PubChem (CID 56817472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).