2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol

C14H24N4O — CID 12043754

IUPAC2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol
SMILESCCCCC(CO)Nc1nc(N)nc2c1CCCC2
InChIInChI=1S/C14H24N4O/c1-2-3-6-10(9-19)16-13-11-7-4-5-8-12(11)17-14(15)18-13/h10,19H,2-9H2,1H3,(H3,15,16,17,18)
InChIKeyWERMNPDGKRWANQ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.90
Rot. Bonds6

About 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol

2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol (PubChem CID 12043754) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol.

Molecular Properties

Compound Name2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol
PubChem CID12043754
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol
SMILESCCCCC(CO)Nc1nc(N)nc2c1CCCC2
InChIInChI=1S/C14H24N4O/c1-2-3-6-10(9-19)16-13-11-7-4-5-8-12(11)17-14(15)18-13/h10,19H,2-9H2,1H3,(H3,15,16,17,18)
InChIKeyWERMNPDGKRWANQ-UHFFFAOYSA-N
XLogP1.90
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol with MolForge

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Related Compounds

4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-5,6,7,8-tetrahydroquinazolin-2-amine
CID 24992735
4-N-butyl-5-[3-[2-methoxyethyl(methyl)amino]propyl]-6-methylpyrimidine-2,4-diamine
CID 135271018
4-N-butyl-6-methyl-5-(4-morpholin-4-ylbutyl)pyrimidine-2,4-diamine
CID 135271039
2-{[6-Methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinyl]amino}ethanol
CID 2941817
4-[2-Amino-4-(butylamino)-6-methylpyrimidin-5-yl]butan-1-ol
CID 135260399
4-[2-Amino-4-(butylamino)-6-methylpyrimidin-5-yl]-2-methylbutan-2-ol
CID 135260404
5-[2-Amino-4-(butylamino)-6-methylpyrimidin-5-yl]-2-methylpentan-2-ol
CID 135260416
1-[(2-Amino-6-ethyl-5-methylpyrimidin-4-YL)amino]-3-(dimethylamino)propan-2-OL
CID 72863959
rac-(3S,4S)-4-(dimethylamino)-1-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)pyrrolidin-3-ol
CID 129621576
(2S)-2-hydroxy-3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]propanamide
CID 164636600
2-N,2-N-dimethyl-4-N-[4-(4-methylpiperazin-1-yl)oxolan-3-yl]-5,6,7,8-tetrahydroquinazoline-2,4-diamine
CID 171358995
[(2S)-1-(2-chloro-7-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)pyrrolidin-2-yl]methanol
CID 166003461

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol?
The IUPAC name of 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol (CID 12043754) is 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol.
What is the SMILES notation for 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol?
The canonical SMILES for 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol is CCCCC(CO)Nc1nc(N)nc2c1CCCC2.
What is the InChIKey of 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol?
The InChIKey is WERMNPDGKRWANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-2-3-6-10(9-19)16-13-11-7-4-5-8-12(11)17-14(15)18-13/h10,19H,2-9H2,1H3,(H3,15,16,17,18).
What are the key properties of 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol?
2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol has a molecular weight of 264.37 g/mol, XLogP of 1.90, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)amino]hexan-1-ol is sourced from PubChem (CID 12043754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).