4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine

C15H27N5 — CID 83118042

IUPAC4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine
SMILESCCNc1nc(C)cc(NCC2(N(C)C)CCCC2)n1
InChIInChI=1S/C15H27N5/c1-5-16-14-18-12(2)10-13(19-14)17-11-15(20(3)4)8-6-7-9-15/h10H,5-9,11H2,1-4H3,(H2,16,17,18,19)
InChIKeyVNFUGSJUMZPSBE-UHFFFAOYSA-N
MW277.42 g/mol
LogP2.50
Rot. Bonds6

About 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine

4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine (PubChem CID 83118042) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine
PubChem CID83118042
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine
SMILESCCNc1nc(C)cc(NCC2(N(C)C)CCCC2)n1
InChIInChI=1S/C15H27N5/c1-5-16-14-18-12(2)10-13(19-14)17-11-15(20(3)4)8-6-7-9-15/h10H,5-9,11H2,1-4H3,(H2,16,17,18,19)
InChIKeyVNFUGSJUMZPSBE-UHFFFAOYSA-N
XLogP2.50
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-ethyl-6-methyl-4-N-(1-methylcyclopentyl)pyrimidine-2,4-diamine
CID 80840740
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine
CID 105420925
4-ethyl-1-[[[2-(ethylamino)-6-methylpyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 80827870
6-chloro-2-N-[[1-(dimethylamino)cyclopentyl]methyl]pyridine-2,4-diamine
CID 104923863
N-[[1-(dimethylamino)cyclopentyl]methyl]-4-methylpyrimidin-2-amine
CID 78995555
4-N-[3-(dimethylamino)propyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine
CID 80777282
2-N,6-dimethyl-4-N-[(1-propylcyclopropyl)methyl]pyrimidine-2,4-diamine
CID 114102557
1-[[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 80842622
2-cyclopropyl-4-N-[[1-(dimethylamino)cyclopentyl]methyl]pyrimidine-4,6-diamine
CID 83117793
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-ethyl-6-N-propylpyrimidine-4,6-diamine
CID 105420855
3-[[2-(ethylamino)-6-methylpyrimidin-4-yl]amino]-N,N-dimethylpropanamide
CID 80814270
2-tert-butyl-6-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]pyrimidin-4-amine
CID 83113055

Frequently Asked Questions

What is the IUPAC name of 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine?
The IUPAC name of 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine (CID 83118042) is 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine?
The canonical SMILES for 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine is CCNc1nc(C)cc(NCC2(N(C)C)CCCC2)n1.
What is the InChIKey of 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine?
The InChIKey is VNFUGSJUMZPSBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-5-16-14-18-12(2)10-13(19-14)17-11-15(20(3)4)8-6-7-9-15/h10H,5-9,11H2,1-4H3,(H2,16,17,18,19).
What are the key properties of 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine?
4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine has a molecular weight of 277.42 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine is sourced from PubChem (CID 83118042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).