N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine

C19H34N6 — CID 142760300

IUPACN'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine
SMILESCNCCCCCN(C)c1cc(N2CCCC2)nc(N2CCCC2)n1
InChIInChI=1S/C19H34N6/c1-20-10-4-3-5-11-23(2)17-16-18(24-12-6-7-13-24)22-19(21-17)25-14-8-9-15-25/h16,20H,3-15H2,1-2H3
InChIKeyXVXNAVSOIMCLJV-UHFFFAOYSA-N
MW346.52 g/mol
LogP2.50
Rot. Bonds9

About N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine

N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine (PubChem CID 142760300) has the molecular formula C19H34N6 and a molecular weight of 346.52 g/mol. Its IUPAC name is N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine.

Molecular Properties

Compound NameN'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine
PubChem CID142760300
Molecular FormulaC19H34N6
Molecular Weight346.52 g/mol
Exact Mass346.28
IUPAC NameN'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine
SMILESCNCCCCCN(C)c1cc(N2CCCC2)nc(N2CCCC2)n1
InChIInChI=1S/C19H34N6/c1-20-10-4-3-5-11-23(2)17-16-18(24-12-6-7-13-24)22-19(21-17)25-14-8-9-15-25/h16,20H,3-15H2,1-2H3
InChIKeyXVXNAVSOIMCLJV-UHFFFAOYSA-N
XLogP2.50
TPSA47.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.52
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-[3-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-methylamino]propyl]-N,N'-dimethylpropane-1,3-diamine
CID 67535421
N-[2-(2-methoxyethoxy)ethyl]-N-methyl-2,6-dipyrrolidin-1-ylpyrimidin-4-amine
CID 54086029
N-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N',N'-diethylpentane-1,5-diamine
CID 67535108
4-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-2,6-dipyrrolidin-1-ylpyrimidine
CID 57355688
N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)pentane-1,5-diamine
CID 67534033
N'-[2-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl]-N'-methylethane-1,2-diamine
CID 67529044
N-ethyl-N-phenyl-2,6-dipyrrolidin-1-ylpyrimidin-4-amine
CID 173080172
3-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-N-methylpropan-1-amine
CID 62745440
N,6-dimethyl-N-(2-pyridin-4-ylethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112909455
N,2-dimethyl-6-piperidin-1-yl-N-(2-pyridin-4-ylethyl)pyrimidin-4-amine
CID 112868823
4-N-butyl-2-N,4-N-dimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80753745
4-(azepan-1-yl)-N-methyl-N-octylpyrimidin-2-amine
CID 66904228

Frequently Asked Questions

What is the IUPAC name of N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine?
The IUPAC name of N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine (CID 142760300) is N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine.
What is the SMILES notation for N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine?
The canonical SMILES for N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine is CNCCCCCN(C)c1cc(N2CCCC2)nc(N2CCCC2)n1.
What is the InChIKey of N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine?
The InChIKey is XVXNAVSOIMCLJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N6/c1-20-10-4-3-5-11-23(2)17-16-18(24-12-6-7-13-24)22-19(21-17)25-14-8-9-15-25/h16,20H,3-15H2,1-2H3.
What are the key properties of N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine?
N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine has a molecular weight of 346.52 g/mol, XLogP of 2.50, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-N,N'-dimethylpentane-1,5-diamine is sourced from PubChem (CID 142760300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).