5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine

C14H18N4O — CID 72937788

IUPAC5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine
SMILESCCc1cnc(NCC(C)Oc2cccnc2)nc1
InChIInChI=1S/C14H18N4O/c1-3-12-8-17-14(18-9-12)16-7-11(2)19-13-5-4-6-15-10-13/h4-6,8-11H,3,7H2,1-2H3,(H,16,17,18)
InChIKeyYFVHYJXFFZRZON-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.31
Rot. Bonds6

About 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine

5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine (PubChem CID 72937788) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine
PubChem CID72937788
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine
SMILESCCc1cnc(NCC(C)Oc2cccnc2)nc1
InChIInChI=1S/C14H18N4O/c1-3-12-8-17-14(18-9-12)16-7-11(2)19-13-5-4-6-15-10-13/h4-6,8-11H,3,7H2,1-2H3,(H,16,17,18)
InChIKeyYFVHYJXFFZRZON-UHFFFAOYSA-N
XLogP2.31
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-pyridin-3-yloxypropyl]pentan-3-amine
CID 94497598
N-(2-pyridin-3-yloxypropyl)pentan-2-amine
CID 62583825
6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine
CID 56739047
1-N-(5-ethylpyrimidin-2-yl)propane-1,2-diamine
CID 116974283
5-tert-butyl-N-[(2S)-2-pyridin-3-yloxypropyl]-1,3,4-oxadiazol-2-amine
CID 97155547
6-cyclopropyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidin-4-amine
CID 97151701
N-[2-(4-chlorophenoxy)propyl]-5-methylpyrimidin-2-amine
CID 133403569
2-ethylsulfanyl-N-[(2R)-2-pyridin-3-yloxypropyl]acetamide
CID 124753809
N-(3-methoxypropyl)-2-pyridin-3-yloxypropan-1-amine
CID 62583823
(2S)-N-(benzylsulfamoyl)-2-pyridin-3-yloxypropan-1-amine
CID 95399042
N-(benzylsulfamoyl)-2-pyridin-3-yloxypropan-1-amine
CID 56861099
6-ethyl-2-morpholin-4-yl-N-(2-pyridin-3-yloxypropyl)pyrimidin-4-amine
CID 134698488

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine?
The IUPAC name of 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine (CID 72937788) is 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine.
What is the SMILES notation for 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine?
The canonical SMILES for 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine is CCc1cnc(NCC(C)Oc2cccnc2)nc1.
What is the InChIKey of 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine?
The InChIKey is YFVHYJXFFZRZON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-3-12-8-17-14(18-9-12)16-7-11(2)19-13-5-4-6-15-10-13/h4-6,8-11H,3,7H2,1-2H3,(H,16,17,18).
What are the key properties of 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine?
5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine has a molecular weight of 258.32 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(2-pyridin-3-yloxypropyl)pyrimidin-2-amine is sourced from PubChem (CID 72937788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).