N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine

C15H28N4 — CID 83186165

IUPACN-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine
SMILESCCCCN(c1ncc(CNC)c(C)n1)C(C)CC
InChIInChI=1S/C15H28N4/c1-6-8-9-19(12(3)7-2)15-17-11-14(10-16-5)13(4)18-15/h11-12,16H,6-10H2,1-5H3
InChIKeyUQFHVKAUTMPNMF-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.91
Rot. Bonds8

About N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine

N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine (PubChem CID 83186165) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine
PubChem CID83186165
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC NameN-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine
SMILESCCCCN(c1ncc(CNC)c(C)n1)C(C)CC
InChIInChI=1S/C15H28N4/c1-6-8-9-19(12(3)7-2)15-17-11-14(10-16-5)13(4)18-15/h11-12,16H,6-10H2,1-5H3
InChIKeyUQFHVKAUTMPNMF-UHFFFAOYSA-N
XLogP2.91
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dibutyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine
CID 83185864
N-butan-2-yl-N-butyl-5-(methylaminomethyl)pyrimidin-2-amine
CID 113388169
N-butan-2-yl-N-butyl-3-(methylaminomethyl)pyridin-2-amine
CID 62287854
N-butan-2-yl-N-butyl-3-fluoro-4-(methylaminomethyl)pyridin-2-amine
CID 105389718
N-ethyl-4-methyl-N-propan-2-yl-5-[(propan-2-ylamino)methyl]pyrimidin-2-amine
CID 83185946
5-[(cyclopropylamino)methyl]-4-methyl-N-propan-2-yl-N-propylpyrimidin-2-amine
CID 83185509
N-ethyl-4-methyl-5-(methylaminomethyl)-N-phenylpyrimidin-2-amine
CID 83185236
[4-methyl-2-[propan-2-yl(propyl)amino]pyrimidin-5-yl]methanol
CID 83185065
5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine
CID 83185815
N,4-dimethyl-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrimidin-2-amine
CID 83186354
N,4-dimethyl-5-(methylaminomethyl)-N-(oxan-4-yl)pyrimidin-2-amine
CID 83185622
N,4-dimethyl-5-(methylaminomethyl)-N-(2-methylsulfonylethyl)pyrimidin-2-amine
CID 83189165

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine?
The IUPAC name of N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine (CID 83186165) is N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine.
What is the SMILES notation for N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine?
The canonical SMILES for N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine is CCCCN(c1ncc(CNC)c(C)n1)C(C)CC.
What is the InChIKey of N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine?
The InChIKey is UQFHVKAUTMPNMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-6-8-9-19(12(3)7-2)15-17-11-14(10-16-5)13(4)18-15/h11-12,16H,6-10H2,1-5H3.
What are the key properties of N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine?
N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine has a molecular weight of 264.42 g/mol, XLogP of 2.91, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-N-butyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine is sourced from PubChem (CID 83186165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).