6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine

C11H21N5 — CID 115263882

IUPAC6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine
SMILESCCN(C)c1cc(NC(C)(C)CN)ncn1
InChIInChI=1S/C11H21N5/c1-5-16(4)10-6-9(13-8-14-10)15-11(2,3)7-12/h6,8H,5,7,12H2,1-4H3,(H,13,14,15)
InChIKeySDZLNNVSCIIFHI-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.08
Rot. Bonds5

About 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine

6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine (PubChem CID 115263882) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine
PubChem CID115263882
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC Name6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine
SMILESCCN(C)c1cc(NC(C)(C)CN)ncn1
InChIInChI=1S/C11H21N5/c1-5-16(4)10-6-9(13-8-14-10)15-11(2,3)7-12/h6,8H,5,7,12H2,1-4H3,(H,13,14,15)
InChIKeySDZLNNVSCIIFHI-UHFFFAOYSA-N
XLogP1.08
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N,2-dimethylpyrimidine-4,6-diamine
CID 115266385
1-[[6-[ethyl(methyl)amino]pyrimidin-4-yl]amino]propan-2-one
CID 115265039
4-N-methyl-6-N-[2-methyl-1-(methylamino)propan-2-yl]-4-N-propylpyrimidine-4,6-diamine
CID 115264458
6-N-(4-aminophenyl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine
CID 115264271
methyl 3-[[6-[ethyl(methyl)amino]pyrimidin-4-yl]amino]propanoate
CID 115264973
2-[[6-[ethyl(methyl)amino]pyrimidin-4-yl]amino]propanoic acid
CID 115264319
4-N-(1-amino-2-methylpropan-2-yl)-6-N-(cyclobutylmethyl)pyrimidine-4,6-diamine
CID 115263895
N-ethyl-N-methyl-6-(2-methylpentan-2-yl)pyrimidin-4-amine
CID 134483265
6-N-(2-amino-2-methylpropyl)-4-N-methyl-4-N-pentylpyrimidine-4,6-diamine
CID 115263934
6-N-tert-butyl-4-N-methyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-4,6-diamine
CID 112861806
4-N-cyclobutyl-4-N-methyl-6-N-[2-methyl-1-(methylamino)propan-2-yl]pyrimidine-4,6-diamine
CID 115264462
4-N-(1-aminopropan-2-yl)-6-N-(2,2-dimethylpropyl)-4-N-methylpyrimidine-4,6-diamine
CID 115265922

Frequently Asked Questions

What is the IUPAC name of 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine?
The IUPAC name of 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine (CID 115263882) is 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine?
The canonical SMILES for 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine is CCN(C)c1cc(NC(C)(C)CN)ncn1.
What is the InChIKey of 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine?
The InChIKey is SDZLNNVSCIIFHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-5-16(4)10-6-9(13-8-14-10)15-11(2,3)7-12/h6,8H,5,7,12H2,1-4H3,(H,13,14,15).
What are the key properties of 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine?
6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine has a molecular weight of 223.32 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(1-amino-2-methylpropan-2-yl)-4-N-ethyl-4-N-methylpyrimidine-4,6-diamine is sourced from PubChem (CID 115263882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).