2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide

C14H17N5O — CID 115915522

IUPAC2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide
SMILESCC(C)(Nc1cc(N)nc(-c2ccccc2)n1)C(N)=O
InChIInChI=1S/C14H17N5O/c1-14(2,13(16)20)19-11-8-10(15)17-12(18-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,16,20)(H3,15,17,18,19)
InChIKeyWUXRFIJLDMUQST-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.40
Rot. Bonds4

About 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide

2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide (PubChem CID 115915522) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide
PubChem CID115915522
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide
SMILESCC(C)(Nc1cc(N)nc(-c2ccccc2)n1)C(N)=O
InChIInChI=1S/C14H17N5O/c1-14(2,13(16)20)19-11-8-10(15)17-12(18-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,16,20)(H3,15,17,18,19)
InChIKeyWUXRFIJLDMUQST-UHFFFAOYSA-N
XLogP1.40
TPSA106.92 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(3-methylpentan-3-yl)-2-phenylpyrimidine-4,6-diamine
CID 106332100
2-[(6-amino-2-phenylpyrimidin-4-yl)amino]propanamide
CID 112559814
4-N-ethyl-2-phenylpyrimidine-4,6-diamine
CID 112559773
3-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2,2-difluoropropan-1-ol
CID 106179314
2-methyl-2-(quinoxalin-2-ylamino)propanamide
CID 62360239
5-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpentan-1-ol
CID 106163239
2-[(6-amino-2-phenylpyrimidin-4-yl)amino]propane-1,3-diol
CID 112559838
2-[(6-aminopyrazin-2-yl)amino]-2-methylpropanamide
CID 80646628
3-[(6-amino-2-phenylpyrimidin-4-yl)amino]-4-methylpentan-1-ol
CID 106358096
3-[2-[(6-amino-2-phenylpyrimidin-4-yl)amino]ethylsulfanyl]propan-1-ol
CID 106311691
4-N-(furan-2-ylmethyl)-2-phenylpyrimidine-4,6-diamine
CID 115915230
4-[(6-amino-2-phenylpyrimidin-4-yl)amino]benzenesulfonamide
CID 631044

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide?
The IUPAC name of 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide (CID 115915522) is 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide.
What is the SMILES notation for 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide?
The canonical SMILES for 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide is CC(C)(Nc1cc(N)nc(-c2ccccc2)n1)C(N)=O.
What is the InChIKey of 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide?
The InChIKey is WUXRFIJLDMUQST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-14(2,13(16)20)19-11-8-10(15)17-12(18-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,16,20)(H3,15,17,18,19).
What are the key properties of 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide?
2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide has a molecular weight of 271.32 g/mol, XLogP of 1.40, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2-methylpropanamide is sourced from PubChem (CID 115915522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).