2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine

C9H15N5 — CID 121204907

IUPAC2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine
SMILESNCCNc1nccc(NC2CC2)n1
InChIInChI=1S/C9H15N5/c10-4-6-12-9-11-5-3-8(14-9)13-7-1-2-7/h3,5,7H,1-2,4,6,10H2,(H2,11,12,13,14)
InChIKeyWOLGCZKEYQNHKI-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.42
Rot. Bonds5

About 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine

2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine (PubChem CID 121204907) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine
PubChem CID121204907
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine
SMILESNCCNc1nccc(NC2CC2)n1
InChIInChI=1S/C9H15N5/c10-4-6-12-9-11-5-3-8(14-9)13-7-1-2-7/h3,5,7H,1-2,4,6,10H2,(H2,11,12,13,14)
InChIKeyWOLGCZKEYQNHKI-UHFFFAOYSA-N
XLogP0.42
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-cyclopropyl-2-N-propylpyrimidine-2,4-diamine
CID 80765650
2-N-[2-(4-chlorophenyl)ethyl]-4-N-cyclopropylpyrimidine-2,4-diamine
CID 112882257
4-N-cyclopropyl-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112882231
2-N,4-N-dicyclopentylpyrimidine-2,4-diamine
CID 112884114
4-[(2-hydrazinylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 80932479
2-N-cyclopropyl-4-N-(3-methylbutyl)pyrimidine-2,4-diamine
CID 112882404
4-N-cyclohexyl-2-N-prop-2-enylpyrimidine-2,4-diamine
CID 112882659
4-[[2-(propylamino)pyrimidin-4-yl]amino]pyrrolidin-2-one
CID 114157086
N'-(4-cyclopropylpyrimidin-2-yl)propane-1,3-diamine
CID 83830250
ethyl 4-[[2-(butylamino)pyrimidin-4-yl]amino]piperidine-1-carboxylate
CID 112883042
2-N-[(2-chlorophenyl)methyl]-4-N-cyclohexylpyrimidine-2,4-diamine
CID 112884764
4-N-cyclohexyl-2-N-(pyridin-3-ylmethyl)pyrimidine-2,4-diamine
CID 112884771

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine?
The IUPAC name of 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine (CID 121204907) is 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine.
What is the SMILES notation for 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine?
The canonical SMILES for 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine is NCCNc1nccc(NC2CC2)n1.
What is the InChIKey of 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine?
The InChIKey is WOLGCZKEYQNHKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c10-4-6-12-9-11-5-3-8(14-9)13-7-1-2-7/h3,5,7H,1-2,4,6,10H2,(H2,11,12,13,14).
What are the key properties of 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine?
2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine has a molecular weight of 193.25 g/mol, XLogP of 0.42, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-aminoethyl)-4-N-cyclopropylpyrimidine-2,4-diamine is sourced from PubChem (CID 121204907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).