4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine

C14H17N5O — CID 112886382

IUPAC4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine
SMILESc1cncc(CNc2nccc(N3CCOCC3)n2)c1
InChIInChI=1S/C14H17N5O/c1-2-12(10-15-4-1)11-17-14-16-5-3-13(18-14)19-6-8-20-9-7-19/h1-5,10H,6-9,11H2,(H,16,17,18)
InChIKeyFDDMHSSEICVYPN-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.32
Rot. Bonds4

About 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine

4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine (PubChem CID 112886382) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine
PubChem CID112886382
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine
SMILESc1cncc(CNc2nccc(N3CCOCC3)n2)c1
InChIInChI=1S/C14H17N5O/c1-2-12(10-15-4-1)11-17-14-16-5-3-13(18-14)19-6-8-20-9-7-19/h1-5,10H,6-9,11H2,(H,16,17,18)
InChIKeyFDDMHSSEICVYPN-UHFFFAOYSA-N
XLogP1.32
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridin-3-amine
CID 43724741
4-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-2-amine
CID 112886384
4-morpholin-4-yl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyrimidin-2-amine
CID 166228948
4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(pyridin-3-ylmethyl)pyrimidin-2-amine
CID 112893579
6-morpholin-4-yl-4-N-(pyridin-3-ylmethyl)pyridine-3,4-diamine
CID 90161049
4-methoxy-6-morpholin-4-yl-N-(pyridin-3-ylmethyl)-1,3,5-triazin-2-amine
CID 171982985
4-[2-[4-(2-pyridin-3-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 166604793
1-[4-morpholin-4-yl-6-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]-3-(pyridin-3-ylmethyl)thiourea
CID 100782311
4-[2-(benzylamino)pyrimidin-4-yl]piperazine-1-carbaldehyde
CID 112888503
2-morpholin-4-yl-6-phenyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 112935500
4-N-benzyl-2-N-(pyridin-3-ylmethyl)pyrimidine-2,4-diamine
CID 112889409
6-methyl-2-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 112912257

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine?
The IUPAC name of 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine (CID 112886382) is 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine?
The canonical SMILES for 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine is c1cncc(CNc2nccc(N3CCOCC3)n2)c1.
What is the InChIKey of 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine?
The InChIKey is FDDMHSSEICVYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-2-12(10-15-4-1)11-17-14-16-5-3-13(18-14)19-6-8-20-9-7-19/h1-5,10H,6-9,11H2,(H,16,17,18).
What are the key properties of 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine?
4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine has a molecular weight of 271.32 g/mol, XLogP of 1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine is sourced from PubChem (CID 112886382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).