2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine

C14H25N5 — CID 80801780

IUPAC2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine
SMILESCc1nc(N)c(C)c(NC(C)CN2CCCCC2)n1
InChIInChI=1S/C14H25N5/c1-10(9-19-7-5-4-6-8-19)16-14-11(2)13(15)17-12(3)18-14/h10H,4-9H2,1-3H3,(H3,15,16,17,18)
InChIKeyBOELVMADCDNYSJ-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.96
Rot. Bonds4

About 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine

2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine (PubChem CID 80801780) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine
PubChem CID80801780
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine
SMILESCc1nc(N)c(C)c(NC(C)CN2CCCCC2)n1
InChIInChI=1S/C14H25N5/c1-10(9-19-7-5-4-6-8-19)16-14-11(2)13(15)17-12(3)18-14/h10H,4-9H2,1-3H3,(H3,15,16,17,18)
InChIKeyBOELVMADCDNYSJ-UHFFFAOYSA-N
XLogP1.96
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-hydrazinyl-2,5-dimethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897399
6-N-ethyl-2,5-dimethyl-4-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80801137
2,5-dimethyl-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 80766348
6-hydrazinyl-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897697
6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine
CID 55168144
4-[(6-amino-2,5-dimethylpyrimidin-4-yl)amino]pentan-1-ol
CID 80852682
6-hydrazinyl-2,5-dimethyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
CID 80914851
3-nitro-2-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-2,6-diamine
CID 80800240
3,6-dichloro-N-(1-piperidin-1-ylpropan-2-yl)-1,2,4-triazin-5-amine
CID 81036944
6-chloro-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,5-diamine
CID 63022906
6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-2,3-diamine
CID 115320544
2-[(6-amino-2,5-dimethylpyrimidin-4-yl)amino]-1-pyrrolidin-1-ylethanone
CID 113406499

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine?
The IUPAC name of 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine (CID 80801780) is 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine.
What is the SMILES notation for 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine?
The canonical SMILES for 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine is Cc1nc(N)c(C)c(NC(C)CN2CCCCC2)n1.
What is the InChIKey of 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine?
The InChIKey is BOELVMADCDNYSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-10(9-19-7-5-4-6-8-19)16-14-11(2)13(15)17-12(3)18-14/h10H,4-9H2,1-3H3,(H3,15,16,17,18).
What are the key properties of 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine?
2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine has a molecular weight of 263.39 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine is sourced from PubChem (CID 80801780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).