N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide

C14H25N5O — CID 106918632

IUPACN,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide
SMILESCCCNc1cc(N(C)CC(C)C(=O)NC)nc(C)n1
InChIInChI=1S/C14H25N5O/c1-6-7-16-12-8-13(18-11(3)17-12)19(5)9-10(2)14(20)15-4/h8,10H,6-7,9H2,1-5H3,(H,15,20)(H,16,17,18)
InChIKeyYTTCAQSSQOEQLN-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.43
Rot. Bonds7

About N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide

N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide (PubChem CID 106918632) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide
PubChem CID106918632
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC NameN,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide
SMILESCCCNc1cc(N(C)CC(C)C(=O)NC)nc(C)n1
InChIInChI=1S/C14H25N5O/c1-6-7-16-12-8-13(18-11(3)17-12)19(5)9-10(2)14(20)15-4/h8,10H,6-7,9H2,1-5H3,(H,15,20)(H,16,17,18)
InChIKeyYTTCAQSSQOEQLN-UHFFFAOYSA-N
XLogP1.43
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-hydrazinyl-2-methylpyrimidin-4-yl)-methylamino]-N,2-dimethylpropanamide
CID 106918798
2-methyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanenitrile
CID 80809902
2-methyl-1-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80848388
N-methyl-2-[[2-methyl-6-(propylamino)pyrimidin-4-yl]-propylamino]acetamide
CID 80806263
3-[[2-(ethoxymethyl)-6-(methylamino)pyrimidin-4-yl]-methylamino]-N,2-dimethylpropanamide
CID 106918706
1-[methyl-[2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80957681
6-N-(3-aminobutyl)-4-N,2-dimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
CID 115266442
N-[2-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]ethyl]-2-ethylbutanamide
CID 121074604
2-methyl-4-N-(4-methylpentyl)-6-N-propylpyrimidine-4,6-diamine
CID 80831566
4-N-(1-cyclopropylethyl)-4-N,2-dimethyl-6-N-propylpyrimidine-4,6-diamine
CID 80793618
N,2-dimethyl-3-[methyl-[6-(methylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]propanamide
CID 106918708
N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide
CID 106917955

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide?
The IUPAC name of N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide (CID 106918632) is N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide.
What is the SMILES notation for N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide?
The canonical SMILES for N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide is CCCNc1cc(N(C)CC(C)C(=O)NC)nc(C)n1.
What is the InChIKey of N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide?
The InChIKey is YTTCAQSSQOEQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-6-7-16-12-8-13(18-11(3)17-12)19(5)9-10(2)14(20)15-4/h8,10H,6-7,9H2,1-5H3,(H,15,20)(H,16,17,18).
What are the key properties of N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide?
N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide has a molecular weight of 279.39 g/mol, XLogP of 1.43, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-[methyl-[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide is sourced from PubChem (CID 106918632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).