N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide

C14H18N4O — CID 103111298

IUPACN-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide
SMILESCCN(C)C(=O)C(C)Nc1ncnc2ccccc12
InChIInChI=1S/C14H18N4O/c1-4-18(3)14(19)10(2)17-13-11-7-5-6-8-12(11)15-9-16-13/h5-10H,4H2,1-3H3,(H,15,16,17)
InChIKeyBSFYFWCIFMMZLF-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.91
Rot. Bonds4

About N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide

N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide (PubChem CID 103111298) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide
PubChem CID103111298
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide
SMILESCCN(C)C(=O)C(C)Nc1ncnc2ccccc12
InChIInChI=1S/C14H18N4O/c1-4-18(3)14(19)10(2)17-13-11-7-5-6-8-12(11)15-9-16-13/h5-10H,4H2,1-3H3,(H,15,16,17)
InChIKeyBSFYFWCIFMMZLF-UHFFFAOYSA-N
XLogP1.91
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-aminoquinazolin-4-yl)amino]-N-ethyl-N-methylpropanamide
CID 103114058
N-[2-(diethylamino)ethyl]-2-(quinazolin-4-ylamino)propanamide
CID 110436209
(2R)-4-methyl-2-(quinazolin-4-ylamino)pentanoate
CID 6922206
(2R,3S)-3-methyl-2-(quinazolin-4-ylamino)pentanoic acid
CID 725448
(2S,3S)-3-methyl-2-(quinazolin-4-ylamino)pentanoate
CID 6928136
N-ethyl-2-[(7-hydroxyisoquinolin-1-yl)amino]-N-methylpropanamide
CID 106540035
2-[(7-chloroquinazolin-4-yl)amino]-N,N-dimethylpropanamide
CID 42961075
2-(quinazolin-4-ylamino)pentanoic acid
CID 3356607
N-ethyl-N-methyl-2-(6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-ylamino)propanamide
CID 103111262
1-piperidin-1-yl-2-(quinazolin-4-ylamino)propan-1-one
CID 110436995
N-[2-(4-fluorophenyl)ethyl]-2-(quinazolin-4-ylamino)propanamide
CID 110436198
3-hydroxy-2-(quinazolin-4-ylamino)propanoic acid
CID 2789318

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide?
The IUPAC name of N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide (CID 103111298) is N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide?
The canonical SMILES for N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide is CCN(C)C(=O)C(C)Nc1ncnc2ccccc12.
What is the InChIKey of N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide?
The InChIKey is BSFYFWCIFMMZLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-4-18(3)14(19)10(2)17-13-11-7-5-6-8-12(11)15-9-16-13/h5-10H,4H2,1-3H3,(H,15,16,17).
What are the key properties of N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide?
N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide has a molecular weight of 258.32 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(quinazolin-4-ylamino)propanamide is sourced from PubChem (CID 103111298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).