4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine

C16H26N4 — CID 80984961

IUPAC4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(NC)c(C)c(N(CC2CC2)C2CC2)n1
InChIInChI=1S/C16H26N4/c1-4-5-14-18-15(17-3)11(2)16(19-14)20(13-8-9-13)10-12-6-7-12/h12-13H,4-10H2,1-3H3,(H,17,18,19)
InChIKeyDNUOZSVAYTUHJG-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.16
Rot. Bonds7

About 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine

4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine (PubChem CID 80984961) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
PubChem CID80984961
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC Name4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(NC)c(C)c(N(CC2CC2)C2CC2)n1
InChIInChI=1S/C16H26N4/c1-4-5-14-18-15(17-3)11(2)16(19-14)20(13-8-9-13)10-12-6-7-12/h12-13H,4-10H2,1-3H3,(H,17,18,19)
InChIKeyDNUOZSVAYTUHJG-UHFFFAOYSA-N
XLogP3.16
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-cyclopropyl-N-(cyclopropylmethyl)-5-methyl-2-propylpyrimidin-4-amine
CID 80978847
4-N-(cyclohexylmethyl)-4-N,6-N,5-trimethyl-2-propylpyrimidine-4,6-diamine
CID 80987928
N-cyclopropyl-6-hydrazinyl-5-methyl-N-(2-methylpropyl)-2-propylpyrimidin-4-amine
CID 81006373
N-cyclopropyl-N-(cyclopropylmethyl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80917857
N-(cyclopropylmethyl)-6-hydrazinyl-5-methyl-N-propan-2-yl-2-propylpyrimidin-4-amine
CID 81006046
6-N,5-dimethyl-4-N-(2-methylcyclopentyl)-2-propylpyrimidine-4,6-diamine
CID 80985581
4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80844060
4-N-cyclohexyl-4-N-ethyl-6-N,2,5-trimethylpyrimidine-4,6-diamine
CID 80767116
N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 81001386
3-[cyclobutyl-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]propan-1-ol
CID 102875785
6-N,5-dimethyl-4-N-(2-methylcycloheptyl)-2-propylpyrimidine-4,6-diamine
CID 80992645
N-ethyl-2-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80987499

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine (CID 80984961) is 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine is CCCc1nc(NC)c(C)c(N(CC2CC2)C2CC2)n1.
What is the InChIKey of 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine?
The InChIKey is DNUOZSVAYTUHJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-4-5-14-18-15(17-3)11(2)16(19-14)20(13-8-9-13)10-12-6-7-12/h12-13H,4-10H2,1-3H3,(H,17,18,19).
What are the key properties of 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine?
4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine has a molecular weight of 274.41 g/mol, XLogP of 3.16, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopropyl-4-N-(cyclopropylmethyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 80984961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).