4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine

C9H14N4 — CID 130595504

IUPAC4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine
SMILESCC(N)c1ccnc(NC2CC2)n1
InChIInChI=1S/C9H14N4/c1-6(10)8-4-5-11-9(13-8)12-7-2-3-7/h4-7H,2-3,10H2,1H3,(H,11,12,13)
InChIKeyWXJGEYCIVNZTPR-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.07
Rot. Bonds3

About 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine

4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine (PubChem CID 130595504) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine
PubChem CID130595504
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine
SMILESCC(N)c1ccnc(NC2CC2)n1
InChIInChI=1S/C9H14N4/c1-6(10)8-4-5-11-9(13-8)12-7-2-3-7/h4-7H,2-3,10H2,1H3,(H,11,12,13)
InChIKeyWXJGEYCIVNZTPR-UHFFFAOYSA-N
XLogP1.07
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-piperidin-4-yl-4-propan-2-ylpyrimidin-2-amine
CID 58990485
N-cyclopropyl-4-iodopyrimidin-2-amine
CID 130116480
2-N-cyclopropyl-4-N-(3-methylbutyl)pyrimidine-2,4-diamine
CID 112882404
4-chloro-N-cyclohexylpyrimidin-2-amine
CID 87190061
N-cyclopropyl-4-ethoxypyrimidin-2-amine
CID 94830398
2-[2-(cyclopropylamino)pyrimidin-4-yl]-2-(4-methyl-1,3-thiazol-2-yl)acetonitrile
CID 90907778
2-[2-(cyclohexylamino)pyrimidin-4-yl]-2-pyridin-2-ylacetonitrile
CID 11346899
2-[2-(cycloheptylamino)pyrimidin-4-yl]-2-pyridin-2-ylacetonitrile
CID 11312842
2-N,4-N-dicyclopentylpyrimidine-2,4-diamine
CID 112884114
4-N-[4-(2-methyl-1-propan-2-ylimidazol-4-yl)pyrimidin-2-yl]cyclohexane-1,4-diamine
CID 140546351
N-cycloheptyl-4-ethoxypyrimidin-2-amine
CID 112636626
N-cyclopropyl-4-(3-methylpyrazin-2-yl)pyrimidin-2-amine
CID 114080483

Frequently Asked Questions

What is the IUPAC name of 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine?
The IUPAC name of 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine (CID 130595504) is 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine.
What is the SMILES notation for 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine?
The canonical SMILES for 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine is CC(N)c1ccnc(NC2CC2)n1.
What is the InChIKey of 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine?
The InChIKey is WXJGEYCIVNZTPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c1-6(10)8-4-5-11-9(13-8)12-7-2-3-7/h4-7H,2-3,10H2,1H3,(H,11,12,13).
What are the key properties of 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine?
4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine has a molecular weight of 178.24 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine is sourced from PubChem (CID 130595504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).