N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide

C14H18N4O — CID 49226597

IUPACN-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide
SMILESCC(C)CNC(=O)CNc1ncnc2ccccc12
InChIInChI=1S/C14H18N4O/c1-10(2)7-15-13(19)8-16-14-11-5-3-4-6-12(11)17-9-18-14/h3-6,9-10H,7-8H2,1-2H3,(H,15,19)(H,16,17,18)
InChIKeyYBMUIVKSAXTKTL-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.81
Rot. Bonds5

About N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide

N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide (PubChem CID 49226597) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide
PubChem CID49226597
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide
SMILESCC(C)CNC(=O)CNc1ncnc2ccccc12
InChIInChI=1S/C14H18N4O/c1-10(2)7-15-13(19)8-16-14-11-5-3-4-6-12(11)17-9-18-14/h3-6,9-10H,7-8H2,1-2H3,(H,15,19)(H,16,17,18)
InChIKeyYBMUIVKSAXTKTL-UHFFFAOYSA-N
XLogP1.81
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-2-(quinazolin-4-ylamino)acetamide
CID 39165546
2-[[2-(quinazolin-4-ylamino)acetyl]amino]acetic acid
CID 21002376
N-(2-methylpropyl)-2-(thieno[2,3-d]pyrimidin-4-ylamino)acetamide
CID 49226606
N-(pyridin-3-ylmethyl)-2-(quinazolin-4-ylamino)acetamide
CID 110436040
2-[(6-amino-5-methoxypyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide
CID 113405779
N-(4-tert-butylphenyl)-2-(quinazolin-4-ylamino)acetamide
CID 110437164
3-methyl-1-(quinazolin-4-ylamino)butan-2-ol
CID 113240545
2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 110446261
2-[(quinazolin-4-ylamino)methyl]butanoic acid
CID 65226835
2-methyl-4-(quinazolin-4-ylamino)butanoic acid
CID 80539709
3-methyl-4-(quinazolin-4-ylamino)butan-1-ol
CID 66106208
2-anilino-N-(2-methylpropyl)acetamide
CID 28565172

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide?
The IUPAC name of N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide (CID 49226597) is N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide is CC(C)CNC(=O)CNc1ncnc2ccccc12.
What is the InChIKey of N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide?
The InChIKey is YBMUIVKSAXTKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10(2)7-15-13(19)8-16-14-11-5-3-4-6-12(11)17-9-18-14/h3-6,9-10H,7-8H2,1-2H3,(H,15,19)(H,16,17,18).
What are the key properties of N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide?
N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide has a molecular weight of 258.32 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide is sourced from PubChem (CID 49226597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).