3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide

C10H15N5O — CID 80849638

IUPAC3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide
SMILESNc1nccc(NCCC(=O)NC2CC2)n1
InChIInChI=1S/C10H15N5O/c11-10-13-5-3-8(15-10)12-6-4-9(16)14-7-1-2-7/h3,5,7H,1-2,4,6H2,(H,14,16)(H3,11,12,13,15)
InChIKeyRFPPFWOGSDYORQ-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.14
Rot. Bonds5

About 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide

3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide (PubChem CID 80849638) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide
PubChem CID80849638
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide
SMILESNc1nccc(NCCC(=O)NC2CC2)n1
InChIInChI=1S/C10H15N5O/c11-10-13-5-3-8(15-10)12-6-4-9(16)14-7-1-2-7/h3,5,7H,1-2,4,6H2,(H,14,16)(H3,11,12,13,15)
InChIKeyRFPPFWOGSDYORQ-UHFFFAOYSA-N
XLogP0.14
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-3-[[2-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80849792
3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide
CID 80849479
3-[[5-amino-6-(2-methylpropoxy)-2-pyridinyl]amino]-N-cyclopropylpropanamide
CID 79377004
2-[(2-chloropyrimidin-4-yl)amino]-N-cyclopropylacetamide
CID 62344056
N-cyclopropyl-4-[(5,6-diamino-2-pyridinyl)amino]butanamide
CID 79825438
4-[(4-aminopyrimidin-2-yl)amino]-N-cyclopropylbutanamide
CID 116796107
N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide
CID 80793366
N-cyclopropyl-3-[(1-methylpyrazol-3-yl)amino]propanamide
CID 79778658
methyl 4-[[2-(cyclopropylamino)-2-oxoethyl]amino]pyrimidine-2-carboxylate
CID 66287042
3-[(2-amino-6-morpholin-4-ylpyrimidin-4-yl)amino]-N-cyclohexylpropanamide
CID 50982599
4-N-[2-[cyclopropyl(methyl)amino]ethyl]pyrimidine-2,4-diamine
CID 80823019
2-[(2-aminopyrimidin-4-yl)amino]-N-ethylacetamide
CID 80787810

Frequently Asked Questions

What is the IUPAC name of 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide?
The IUPAC name of 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide (CID 80849638) is 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide.
What is the SMILES notation for 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide?
The canonical SMILES for 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide is Nc1nccc(NCCC(=O)NC2CC2)n1.
What is the InChIKey of 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide?
The InChIKey is RFPPFWOGSDYORQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c11-10-13-5-3-8(15-10)12-6-4-9(16)14-7-1-2-7/h3,5,7H,1-2,4,6H2,(H,14,16)(H3,11,12,13,15).
What are the key properties of 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide?
3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide has a molecular weight of 221.26 g/mol, XLogP of 0.14, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide is sourced from PubChem (CID 80849638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).