4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide

C24H22N4O3 — CID 68602385

IUPAC4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide
SMILESNc1nc(OCC2CC2)c2cc(-c3ccc(C(=O)NCc4ccco4)cc3)ccc2n1
InChIInChI=1S/C24H22N4O3/c25-24-27-21-10-9-18(12-20(21)23(28-24)31-14-15-3-4-15)16-5-7-17(8-6-16)22(29)26-13-19-2-1-11-30-19/h1-2,5-12,15H,3-4,13-14H2,(H,26,29)(H2,25,27,28)
InChIKeyQZMCDNISEAHJCC-UHFFFAOYSA-N
MW414.47 g/mol
LogP4.19
Rot. Bonds7

About 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide

4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide (PubChem CID 68602385) has the molecular formula C24H22N4O3 and a molecular weight of 414.47 g/mol. Its IUPAC name is 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide
PubChem CID68602385
Molecular FormulaC24H22N4O3
Molecular Weight414.47 g/mol
Exact Mass414.17
IUPAC Name4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide
SMILESNc1nc(OCC2CC2)c2cc(-c3ccc(C(=O)NCc4ccco4)cc3)ccc2n1
InChIInChI=1S/C24H22N4O3/c25-24-27-21-10-9-18(12-20(21)23(28-24)31-14-15-3-4-15)16-5-7-17(8-6-16)22(29)26-13-19-2-1-11-30-19/h1-2,5-12,15H,3-4,13-14H2,(H,26,29)(H2,25,27,28)
InChIKeyQZMCDNISEAHJCC-UHFFFAOYSA-N
XLogP4.19
TPSA103.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.47
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-methoxybenzamide
CID 87511779
4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-cyclopentylbenzamide
CID 68602190
N-(furan-2-ylmethyl)-6-(oxan-4-ylmethoxy)pyridine-3-carboxamide
CID 91815405
4-(2-amino-4-ethoxyquinazolin-6-yl)-N,N-dimethylbenzamide
CID 68599659
4-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 27649984
4-(6-chloro-1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)benzamide
CID 100579855
2,3-diethyl-N-(furan-2-ylmethyl)quinoxaline-6-carboxamide
CID 2302300
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261
3-(4-chlorophenyl)-N-(furan-2-ylmethyl)-2,1-benzoxazole-5-carboxamide
CID 22575714
4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(furan-2-ylmethyl)benzamide
CID 46385483
N-(furan-2-ylmethyl)-2-[4-(phenoxymethyl)piperidin-1-yl]acetamide
CID 60573051
N-(furan-2-ylmethyl)-4-(6-piperidin-1-yl-3-pyridinyl)benzamide
CID 53149916

Frequently Asked Questions

What is the IUPAC name of 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide (CID 68602385) is 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide is Nc1nc(OCC2CC2)c2cc(-c3ccc(C(=O)NCc4ccco4)cc3)ccc2n1.
What is the InChIKey of 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide?
The InChIKey is QZMCDNISEAHJCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O3/c25-24-27-21-10-9-18(12-20(21)23(28-24)31-14-15-3-4-15)16-5-7-17(8-6-16)22(29)26-13-19-2-1-11-30-19/h1-2,5-12,15H,3-4,13-14H2,(H,26,29)(H2,25,27,28).
What are the key properties of 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide?
4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide has a molecular weight of 414.47 g/mol, XLogP of 4.19, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-amino-4-(cyclopropylmethoxy)quinazolin-6-yl]-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 68602385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).