3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide

C11H17N5O — CID 80849479

IUPAC3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide
SMILESCc1cnc(N)nc1NCCC(=O)NC1CC1
InChIInChI=1S/C11H17N5O/c1-7-6-14-11(12)16-10(7)13-5-4-9(17)15-8-2-3-8/h6,8H,2-5H2,1H3,(H,15,17)(H3,12,13,14,16)
InChIKeyINLAQEZNLXCHSE-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.45
Rot. Bonds5

About 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide

3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide (PubChem CID 80849479) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide
PubChem CID80849479
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide
SMILESCc1cnc(N)nc1NCCC(=O)NC1CC1
InChIInChI=1S/C11H17N5O/c1-7-6-14-11(12)16-10(7)13-5-4-9(17)15-8-2-3-8/h6,8H,2-5H2,1H3,(H,15,17)(H3,12,13,14,16)
InChIKeyINLAQEZNLXCHSE-UHFFFAOYSA-N
XLogP0.45
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylacetamide
CID 80793027
3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide
CID 80849638
N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide
CID 91648208
N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide
CID 80922661
2-[(2-amino-5-methylpyrimidin-4-yl)amino]ethyl carbamate
CID 83215057
5-amino-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]pyridine-3-carboxamide
CID 79385386
N-cyclopropyl-3-[(4,6-dimethylpyrimidin-2-yl)amino]propanamide
CID 79393988
4-[(5-amino-3-bromo-4-methyl-2-pyridinyl)amino]-N-cyclopropylbutanamide
CID 104507008
2-[(2-amino-5-nitropyrimidin-4-yl)amino]-N-cyclopropylacetamide
CID 114044387
3-(2-amino-4-methylanilino)-N-cyclopropylpropanamide
CID 79385467
3-[(3-cyanopyrazin-2-yl)amino]-N-cyclopropylpropanamide
CID 79393897
N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide
CID 114598969

Frequently Asked Questions

What is the IUPAC name of 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide?
The IUPAC name of 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide (CID 80849479) is 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide.
What is the SMILES notation for 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide?
The canonical SMILES for 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide is Cc1cnc(N)nc1NCCC(=O)NC1CC1.
What is the InChIKey of 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide?
The InChIKey is INLAQEZNLXCHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-7-6-14-11(12)16-10(7)13-5-4-9(17)15-8-2-3-8/h6,8H,2-5H2,1H3,(H,15,17)(H3,12,13,14,16).
What are the key properties of 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide?
3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide has a molecular weight of 235.29 g/mol, XLogP of 0.45, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide is sourced from PubChem (CID 80849479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).