2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine

C15H19N5 — CID 112884645

IUPAC2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
SMILESc1cc(CNc2ccnc(N3CCCCC3)n2)ccn1
InChIInChI=1S/C15H19N5/c1-2-10-20(11-3-1)15-17-9-6-14(19-15)18-12-13-4-7-16-8-5-13/h4-9H,1-3,10-12H2,(H,17,18,19)
InChIKeyCEAJTXQISOQHLZ-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.47
Rot. Bonds4

About 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine

2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine (PubChem CID 112884645) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
PubChem CID112884645
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
SMILESc1cc(CNc2ccnc(N3CCCCC3)n2)ccn1
InChIInChI=1S/C15H19N5/c1-2-10-20(11-3-1)15-17-9-6-14(19-15)18-12-13-4-7-16-8-5-13/h4-9H,1-3,10-12H2,(H,17,18,19)
InChIKeyCEAJTXQISOQHLZ-UHFFFAOYSA-N
XLogP2.47
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(azepan-1-yl)-N-benzylpyrimidin-4-amine
CID 112889457
4-(azepan-1-yl)-N-(pyridin-4-ylmethyl)pyrimidin-2-amine
CID 112893866
N-benzyl-2-morpholin-4-ylpyrimidin-4-amine
CID 46891015
N-(2-methylpropyl)-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112883142
N-(3-methylbutyl)-2-piperidin-1-ylpyrimidin-4-amine
CID 112884684
N-[(4-fluorophenyl)methyl]-2-(4-methylpiperazin-1-yl)pyrimidin-4-amine
CID 112888087
2-(azepan-1-yl)-N-(3-phenylpropyl)pyrimidin-4-amine
CID 112899263
3-[(2-piperidin-1-ylpyrimidin-4-yl)amino]propanoic acid
CID 122048200
1-[4-[4-(benzylamino)pyrimidin-2-yl]piperazin-1-yl]ethanone
CID 54587266
N-[(4-fluorophenyl)methyl]-2-(3-methylpiperidin-1-yl)pyrimidin-4-amine
CID 112891407
1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]-N-(pyridin-4-ylmethyl)ethanamine
CID 45186889
4-[[(2-morpholin-4-ylpyrimidin-4-yl)amino]methyl]benzoic acid
CID 122048301

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine (CID 112884645) is 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine is c1cc(CNc2ccnc(N3CCCCC3)n2)ccn1.
What is the InChIKey of 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine?
The InChIKey is CEAJTXQISOQHLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-2-10-20(11-3-1)15-17-9-6-14(19-15)18-12-13-4-7-16-8-5-13/h4-9H,1-3,10-12H2,(H,17,18,19).
What are the key properties of 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine?
2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine has a molecular weight of 269.35 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 112884645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).