N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide

C19H25N5O2 — CID 109301556

IUPACN-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide
SMILESCC(Nc1nccc(C(=O)NCCN2CCOCC2)n1)c1ccccc1
InChIInChI=1S/C19H25N5O2/c1-15(16-5-3-2-4-6-16)22-19-21-8-7-17(23-19)18(25)20-9-10-24-11-13-26-14-12-24/h2-8,15H,9-14H2,1H3,(H,20,25)(H,21,22,23)
InChIKeyRDZLBZABWHCFEF-UHFFFAOYSA-N
MW355.44 g/mol
LogP1.71
Rot. Bonds7

About N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide

N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide (PubChem CID 109301556) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide
PubChem CID109301556
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide
SMILESCC(Nc1nccc(C(=O)NCCN2CCOCC2)n1)c1ccccc1
InChIInChI=1S/C19H25N5O2/c1-15(16-5-3-2-4-6-16)22-19-21-8-7-17(23-19)18(25)20-9-10-24-11-13-26-14-12-24/h2-8,15H,9-14H2,1H3,(H,20,25)(H,21,22,23)
InChIKeyRDZLBZABWHCFEF-UHFFFAOYSA-N
XLogP1.71
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-N-(2-morpholin-4-ylethyl)-6-N-(1-phenylethyl)pyridine-2,6-dicarboxamide
CID 109096436
2-(2-methyl-6-propan-2-ylanilino)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide
CID 109301621
2-(2-chloroanilino)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide
CID 109301626
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-yloxyanilino)pyrimidine-4-carboxamide
CID 109301644
N-benzyl-2-(2-morpholin-4-ylethylamino)pyrimidine-4-carboxamide
CID 109301415
2-[(2-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide
CID 109301562
N-(2-morpholin-4-ylethyl)-2-(4-phenylpiperazin-1-yl)pyrimidine-4-carboxamide
CID 109301579
2-(1-phenylethylamino)-N-prop-2-enylpyrimidine-4-carboxamide
CID 109296133
N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 977791
N-tert-butyl-2-(1-phenylethylamino)pyrimidine-4-carboxamide
CID 109304745
N-cycloheptyl-2-(1-phenylethylamino)pyrimidine-4-carboxamide
CID 109304746
3,4-dihydro-1H-isoquinolin-2-yl-[2-(1-phenylethylamino)pyrimidin-4-yl]methanone
CID 109304723

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide (CID 109301556) is N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide is CC(Nc1nccc(C(=O)NCCN2CCOCC2)n1)c1ccccc1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide?
The InChIKey is RDZLBZABWHCFEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-15(16-5-3-2-4-6-16)22-19-21-8-7-17(23-19)18(25)20-9-10-24-11-13-26-14-12-24/h2-8,15H,9-14H2,1H3,(H,20,25)(H,21,22,23).
What are the key properties of N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide?
N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 1.71, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-2-(1-phenylethylamino)pyrimidine-4-carboxamide is sourced from PubChem (CID 109301556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).