4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine

C14H20N6O — CID 59564852

IUPAC4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
SMILESCc1[nH]ncc1-c1ccnc(NCCN2CCOCC2)n1
InChIInChI=1S/C14H20N6O/c1-11-12(10-17-19-11)13-2-3-15-14(18-13)16-4-5-20-6-8-21-9-7-20/h2-3,10H,4-9H2,1H3,(H,17,19)(H,15,16,18)
InChIKeyYVQFUSSXVLTVOT-UHFFFAOYSA-N
MW288.35 g/mol
LogP0.92
Rot. Bonds5

About 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine

4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine (PubChem CID 59564852) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
PubChem CID59564852
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC Name4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
SMILESCc1[nH]ncc1-c1ccnc(NCCN2CCOCC2)n1
InChIInChI=1S/C14H20N6O/c1-11-12(10-17-19-11)13-2-3-15-14(18-13)16-4-5-20-6-8-21-9-7-20/h2-3,10H,4-9H2,1H3,(H,17,19)(H,15,16,18)
InChIKeyYVQFUSSXVLTVOT-UHFFFAOYSA-N
XLogP0.92
TPSA78.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887262
4-methoxy-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 112683355
N-(2-morpholin-4-ylethyl)-4-propan-2-yloxypyrimidin-2-amine
CID 112636541
3-[2-(benzylamino)pyrimidin-4-yl]-N-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-d]pyrimidin-6-amine
CID 57413712
4-N-[(3-methylphenyl)methyl]-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887443
4-N-cyclopropyl-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112882231
5-(4-chlorophenyl)-4-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 171989086
N-[2-(1H-indol-3-yl)ethyl]-4-(5-methyl-1H-pyrazol-4-yl)pyrimidin-2-amine
CID 59564771
4-[4-(3-methylphenyl)piperazin-1-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 112887479
4-N-[2,6-di(propan-2-yl)phenyl]-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887559
4-[4-(dimethylamino)phenyl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine
CID 162627933
N-(3,5-dimethylphenyl)-2-(2-morpholin-4-ylethylamino)pyrimidine-4-carboxamide
CID 109301473

Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine?
The IUPAC name of 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine (CID 59564852) is 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine?
The canonical SMILES for 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine is Cc1[nH]ncc1-c1ccnc(NCCN2CCOCC2)n1.
What is the InChIKey of 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine?
The InChIKey is YVQFUSSXVLTVOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-11-12(10-17-19-11)13-2-3-15-14(18-13)16-4-5-20-6-8-21-9-7-20/h2-3,10H,4-9H2,1H3,(H,17,19)(H,15,16,18).
What are the key properties of 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine?
4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine has a molecular weight of 288.35 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-1H-pyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine is sourced from PubChem (CID 59564852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).