6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine

C14H24N4O — CID 56718429

IUPAC6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine
SMILESCc1nc(CCN)cc(N(C)CC2CCCCO2)n1
InChIInChI=1S/C14H24N4O/c1-11-16-12(6-7-15)9-14(17-11)18(2)10-13-5-3-4-8-19-13/h9,13H,3-8,10,15H2,1-2H3
InChIKeyIYHVRZPIIPFWLN-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.29
Rot. Bonds5

About 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine

6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine (PubChem CID 56718429) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine
PubChem CID56718429
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine
SMILESCc1nc(CCN)cc(N(C)CC2CCCCO2)n1
InChIInChI=1S/C14H24N4O/c1-11-16-12(6-7-15)9-14(17-11)18(2)10-13-5-3-4-8-19-13/h9,13H,3-8,10,15H2,1-2H3
InChIKeyIYHVRZPIIPFWLN-UHFFFAOYSA-N
XLogP1.29
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-aminoethyl)-N-ethyl-2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrimidin-4-amine
CID 95207222
6-(2-aminoethyl)-N,2-dimethyl-N-[[(2S)-1-methylpiperidin-2-yl]methyl]pyrimidin-4-amine
CID 95211925
4-N,6-dimethyl-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
CID 78928250
4-(2-aminoethyl)-2-chloro-N-methyl-N-(oxan-2-ylmethyl)aniline
CID 81165783
6-chloro-N-methyl-N-(oxan-2-ylmethyl)-2-propylpyrimidin-4-amine
CID 80938173
5-bromo-N,6-dimethyl-N-(oxan-2-ylmethyl)pyridin-2-amine
CID 103915128
6-N-cyclopropyl-4-N-methyl-4-N-(oxan-2-ylmethyl)pyrimidine-2,4,6-triamine
CID 50953322
2-ethyl-6-hydrazinyl-N-methyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine
CID 80937281
4-N,6-dimethyl-4-N-(oxan-2-ylmethyl)-2-N-propylpyrimidine-2,4-diamine
CID 80796286
3-N,4-dimethyl-3-N-(oxan-2-ylmethyl)benzene-1,3-diamine
CID 55091165
3-(aminomethyl)-N,4,6-trimethyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 61430774
2-hydrazinyl-N-methyl-N-(oxan-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine
CID 114567025

Frequently Asked Questions

What is the IUPAC name of 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine (CID 56718429) is 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine is Cc1nc(CCN)cc(N(C)CC2CCCCO2)n1.
What is the InChIKey of 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is IYHVRZPIIPFWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-11-16-12(6-7-15)9-14(17-11)18(2)10-13-5-3-4-8-19-13/h9,13H,3-8,10,15H2,1-2H3.
What are the key properties of 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine?
6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 1.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminoethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 56718429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).