3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol

C15H22N4O2 — CID 106198698

IUPAC3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol
SMILESCCCNc1nc(NC(CO)COC)c2ccccc2n1
InChIInChI=1S/C15H22N4O2/c1-3-8-16-15-18-13-7-5-4-6-12(13)14(19-15)17-11(9-20)10-21-2/h4-7,11,20H,3,8-10H2,1-2H3,(H2,16,17,18,19)
InChIKeyRVLTUNRTYATISY-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.87
Rot. Bonds8

About 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol

3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol (PubChem CID 106198698) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol.

Molecular Properties

Compound Name3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol
PubChem CID106198698
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol
SMILESCCCNc1nc(NC(CO)COC)c2ccccc2n1
InChIInChI=1S/C15H22N4O2/c1-3-8-16-15-18-13-7-5-4-6-12(13)14(19-15)17-11(9-20)10-21-2/h4-7,11,20H,3,8-10H2,1-2H3,(H2,16,17,18,19)
InChIKeyRVLTUNRTYATISY-UHFFFAOYSA-N
XLogP1.87
TPSA79.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol with MolForge

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Related Compounds

2-N-ethyl-4-N-(1-methoxybutan-2-yl)quinazoline-2,4-diamine
CID 80836524
(2S)-3-methyl-2-[[2-(propylamino)quinazolin-4-yl]amino]butan-1-ol
CID 80835823
4-N-(3-methylbutan-2-yl)-2-N-propylquinazoline-2,4-diamine
CID 80753533
2-[[4-chloro-6-(propylamino)-1,3,5-triazin-2-yl]amino]-3-methoxypropan-1-ol
CID 106198836
3-methoxy-2-[[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol
CID 106198781
4-(3-methoxypropoxy)-N-propylquinazolin-2-amine
CID 80866995
4-N-(1-methoxypropan-2-yl)-2-N-methylquinazoline-2,4-diamine
CID 80786241
2-N-propyl-4-N-(2,2,2-trifluoroethyl)quinazoline-2,4-diamine
CID 80778175
2-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-N-propylquinazoline-2,4-diamine
CID 91966287
2-N-[2-(3-methoxyphenyl)ethyl]-4-N-propylquinazoline-2,4-diamine
CID 91966285
2-N-ethyl-4-N-(3-methoxypropyl)quinazoline-2,4-diamine
CID 80771309
N,N-dimethyl-2-[[2-(propylamino)quinazolin-4-yl]amino]acetamide
CID 80771008

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol?
The IUPAC name of 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol (CID 106198698) is 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol.
What is the SMILES notation for 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol?
The canonical SMILES for 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol is CCCNc1nc(NC(CO)COC)c2ccccc2n1.
What is the InChIKey of 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol?
The InChIKey is RVLTUNRTYATISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-3-8-16-15-18-13-7-5-4-6-12(13)14(19-15)17-11(9-20)10-21-2/h4-7,11,20H,3,8-10H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol?
3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol has a molecular weight of 290.37 g/mol, XLogP of 1.87, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-[[2-(propylamino)quinazolin-4-yl]amino]propan-1-ol is sourced from PubChem (CID 106198698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).