N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine

C10H18N4 — CID 106918163

IUPACN,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine
SMILESCNCC(C)CN(C)c1ccncn1
InChIInChI=1S/C10H18N4/c1-9(6-11-2)7-14(3)10-4-5-12-8-13-10/h4-5,8-9,11H,6-7H2,1-3H3
InChIKeyMBUMLZLHHFZOJC-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.77
Rot. Bonds5

About N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine

N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine (PubChem CID 106918163) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine
PubChem CID106918163
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC NameN,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine
SMILESCNCC(C)CN(C)c1ccncn1
InChIInChI=1S/C10H18N4/c1-9(6-11-2)7-14(3)10-4-5-12-8-13-10/h4-5,8-9,11H,6-7H2,1-3H3
InChIKeyMBUMLZLHHFZOJC-UHFFFAOYSA-N
XLogP0.77
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[methyl(pyrimidin-4-yl)amino]propan-2-ol
CID 62332971
N,N',2-trimethyl-N'-(6-methylpyridazin-3-yl)propane-1,3-diamine
CID 106918113
N-(5-iodopyrimidin-4-yl)-N,N',2-trimethylpropane-1,3-diamine
CID 106918118
N,N',2-trimethyl-N'-(3-methylpyrazin-2-yl)propane-1,3-diamine
CID 106918100
N-(5-chloropentyl)-N-methylpyrimidin-4-amine
CID 107205392
1-methyl-3-[methyl-[2-methyl-3-(methylamino)propyl]amino]pyrazin-2-one
CID 106918192
N'-pentan-3-yl-N'-pyrimidin-4-ylethane-1,2-diamine
CID 63759066
N,N',2-trimethyl-N'-[(3-methyl-2-pyridinyl)methyl]propane-1,3-diamine
CID 106915863
3-[methyl(pyrimidin-4-yl)amino]butanoic acid
CID 83619967
2-methyl-3-(methylamino)-N-pyrimidin-4-ylpropanamide
CID 83618247
N-(2-chloroethyl)-N-propylpyrimidin-4-amine
CID 63392396
N,3-dimethyl-1-pyrimidin-4-ylhexan-1-amine
CID 63989784

Frequently Asked Questions

What is the IUPAC name of N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine?
The IUPAC name of N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine (CID 106918163) is N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine.
What is the SMILES notation for N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine?
The canonical SMILES for N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine is CNCC(C)CN(C)c1ccncn1.
What is the InChIKey of N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine?
The InChIKey is MBUMLZLHHFZOJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-9(6-11-2)7-14(3)10-4-5-12-8-13-10/h4-5,8-9,11H,6-7H2,1-3H3.
What are the key properties of N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine?
N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine has a molecular weight of 194.28 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',2-trimethyl-N'-pyrimidin-4-ylpropane-1,3-diamine is sourced from PubChem (CID 106918163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).