2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine

C10H16N4 — CID 127002152

IUPAC2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine
SMILESCCC(Nc1nccc(N)n1)C1CC1
InChIInChI=1S/C10H16N4/c1-2-8(7-3-4-7)13-10-12-6-5-9(11)14-10/h5-8H,2-4H2,1H3,(H3,11,12,13,14)
InChIKeyIDMBHJWNLFLWHZ-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.66
Rot. Bonds4

About 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine

2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine (PubChem CID 127002152) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine
PubChem CID127002152
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine
SMILESCCC(Nc1nccc(N)n1)C1CC1
InChIInChI=1S/C10H16N4/c1-2-8(7-3-4-7)13-10-12-6-5-9(11)14-10/h5-8H,2-4H2,1H3,(H3,11,12,13,14)
InChIKeyIDMBHJWNLFLWHZ-UHFFFAOYSA-N
XLogP1.66
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-N-(4-methylpyrimidin-2-yl)ethane-1,2-diamine
CID 65189145
2-N-(1-cyclohexylpropyl)pyridine-2,4-diamine
CID 55069644
4-N-(1-cyclohexylpropyl)pyridine-2,4-diamine
CID 113367773
1-cyclohexyl-N-(4-methylpyrimidin-2-yl)ethane-1,2-diamine
CID 115309530
1-cyclopentyl-N-(4-propoxypyrimidin-2-yl)ethane-1,2-diamine
CID 106738126
3-cyclopropyl-3-[(4-ethoxypyrimidin-2-yl)amino]propanoic acid
CID 112636256
2-N-(2-ethylcyclohexyl)pyrimidine-2,4-diamine
CID 116795796
2-N-(2-methylpropyl)pyrimidine-2,4-diamine
CID 83695078
2-N-[1-(dimethylamino)-3-methylbutan-2-yl]pyrimidine-2,4-diamine
CID 116795743
2-N-(1-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 116795499
2-N-[(1-ethylpiperidin-2-yl)methyl]pyrimidine-2,4-diamine
CID 131930538
N-(1-cyclopropylpropyl)aniline;hydrochloride
CID 174269039

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine?
The IUPAC name of 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine (CID 127002152) is 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine?
The canonical SMILES for 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine is CCC(Nc1nccc(N)n1)C1CC1.
What is the InChIKey of 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine?
The InChIKey is IDMBHJWNLFLWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-2-8(7-3-4-7)13-10-12-6-5-9(11)14-10/h5-8H,2-4H2,1H3,(H3,11,12,13,14).
What are the key properties of 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine?
2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine has a molecular weight of 192.27 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-cyclopropylpropyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 127002152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).