N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine

C11H17N3O — CID 80681720

IUPACN-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine
SMILESCNc1ccnc(C2(C)CCCCO2)n1
InChIInChI=1S/C11H17N3O/c1-11(6-3-4-8-15-11)10-13-7-5-9(12-2)14-10/h5,7H,3-4,6,8H2,1-2H3,(H,12,13,14)
InChIKeyFECKOXYGDFZNME-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.93
Rot. Bonds2

About N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine

N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine (PubChem CID 80681720) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine
PubChem CID80681720
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine
SMILESCNc1ccnc(C2(C)CCCCO2)n1
InChIInChI=1S/C11H17N3O/c1-11(6-3-4-8-15-11)10-13-7-5-9(12-2)14-10/h5,7H,3-4,6,8H2,1-2H3,(H,12,13,14)
InChIKeyFECKOXYGDFZNME-UHFFFAOYSA-N
XLogP1.93
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N~4~-ethyl-N~2~-(morpholin-2-ylmethyl)pyrimidine-2,4-diamine
CID 50969566
(3R*,4R*)-3-methyl-1-[4-(methylamino)-2-pyrimidinyl]-4-(tetrahydro-2H-pyran-4-yl)-4-piperidinol
CID 72853249
8-ethyl-N-pyrimidin-2-yl-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 118739784
rac-(3R,4R)-N3-(2-methylpyrimidin-4-yl)oxane-3,4-diamine dihydrochloride
CID 165604794
4-[2-(6-Aminohexylamino)-4-pyrimidyl]-morpholine
CID 459123
N-{3-[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]propyl}pyrimidin-4-amine
CID 72884079
2-N-[[(3S)-1-(2-methoxyethyl)piperidin-3-yl]methyl]-2-N,4-N-dimethylpyrimidine-2,4-diamine
CID 95125696
(3S)-3-(2-methylpropyl)-4-(2-methylpyrimidin-4-yl)morpholine
CID 97787777
Cyclohexyl 2-[(2-propan-2-ylpyrimidin-4-yl)amino]acetate
CID 99817845
N~2~-{[1-(methoxymethyl)cyclopentyl]methyl}pyrimidine-2,4-diamine
CID 124214214
1-(Dimethylamino)-2-methyl-3-[[4-(oxan-3-ylamino)pyrimidin-2-yl]amino]propan-2-ol
CID 128967102
2-N,4-N-bis[(2-methyloxan-4-yl)methyl]pyrimidine-2,4-diamine
CID 132393494

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine?
The IUPAC name of N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine (CID 80681720) is N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine?
The canonical SMILES for N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine is CNc1ccnc(C2(C)CCCCO2)n1.
What is the InChIKey of N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine?
The InChIKey is FECKOXYGDFZNME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-11(6-3-4-8-15-11)10-13-7-5-9(12-2)14-10/h5,7H,3-4,6,8H2,1-2H3,(H,12,13,14).
What are the key properties of N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine?
N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine has a molecular weight of 207.28 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 80681720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).