4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine

C14H23N3O2 — CID 112638216

IUPAC4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine
SMILESCCCOc1cc(C)nc(NCC2(C)CCCO2)n1
InChIInChI=1S/C14H23N3O2/c1-4-7-18-12-9-11(2)16-13(17-12)15-10-14(3)6-5-8-19-14/h9H,4-8,10H2,1-3H3,(H,15,16,17)
InChIKeyMTPWXWHVHVBRIS-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.55
Rot. Bonds6

About 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine

4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine (PubChem CID 112638216) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine
PubChem CID112638216
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine
SMILESCCCOc1cc(C)nc(NCC2(C)CCCO2)n1
InChIInChI=1S/C14H23N3O2/c1-4-7-18-12-9-11(2)16-13(17-12)15-10-14(3)6-5-8-19-14/h9H,4-8,10H2,1-3H3,(H,15,16,17)
InChIKeyMTPWXWHVHVBRIS-UHFFFAOYSA-N
XLogP2.55
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-methyloxolan-2-yl)methyl]-4-propoxypyrimidin-2-amine
CID 112638214
2-methyl-3-[[(4-methyl-6-propoxypyrimidin-2-yl)amino]methyl]oxolan-3-ol
CID 106102448
2-methyl-1-N-(4-methyl-6-propoxypyrimidin-2-yl)propane-1,2-diamine
CID 112635096
N-(2,2-dimethylcyclopropyl)-4-methyl-6-propoxypyrimidin-2-amine
CID 112637391
4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine
CID 112636364
N-hexyl-4-methyl-6-propoxypyrimidin-2-amine
CID 112637799
4-methyl-N-prop-2-enyl-6-propoxypyrimidin-2-amine
CID 112637443
6-chloro-2-N-[(2-methyloxolan-2-yl)methyl]-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80855459
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-methyl-6-propoxypyrimidin-2-amine
CID 106374140
4-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-6-propoxypyrimidin-2-amine
CID 112636987
N-(3-chloro-2,2-dimethylpropyl)-4-methyl-6-propoxypyrimidin-2-amine
CID 112635787
N-(3-methoxypropyl)-4-methyl-6-propoxypyrimidin-2-amine
CID 112636619

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine?
The IUPAC name of 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine (CID 112638216) is 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine is CCCOc1cc(C)nc(NCC2(C)CCCO2)n1.
What is the InChIKey of 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine?
The InChIKey is MTPWXWHVHVBRIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-4-7-18-12-9-11(2)16-13(17-12)15-10-14(3)6-5-8-19-14/h9H,4-8,10H2,1-3H3,(H,15,16,17).
What are the key properties of 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine?
4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine has a molecular weight of 265.36 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-propoxypyrimidin-2-amine is sourced from PubChem (CID 112638216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).