N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine

C14H16N4 — CID 62009476

IUPACN-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESCNC1CCCc2nc(-c3cccnc3)ncc21
InChIInChI=1S/C14H16N4/c1-15-12-5-2-6-13-11(12)9-17-14(18-13)10-4-3-7-16-8-10/h3-4,7-9,12,15H,2,5-6H2,1H3
InChIKeyYQFLYSBTCGRLLH-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.14
Rot. Bonds2

About N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine

N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine (PubChem CID 62009476) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine.

Molecular Properties

Compound NameN-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine
PubChem CID62009476
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC NameN-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESCNC1CCCc2nc(-c3cccnc3)ncc21
InChIInChI=1S/C14H16N4/c1-15-12-5-2-6-13-11(12)9-17-14(18-13)10-4-3-7-16-8-10/h3-4,7-9,12,15H,2,5-6H2,1H3
InChIKeyYQFLYSBTCGRLLH-UHFFFAOYSA-N
XLogP2.14
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Amprolium Hydrochloride
CID 8732
Quinazoline
CID 9210
Amprolium
CID 73341
Msx-122
CID 11687907
4-[(E)-2-phenylethenyl]pyrimidin-2-amine
CID 46911068
2-Amino-4-phenylpyrimidine
CID 598777
A804598
CID 53325874
WZ 811
CID 11565518
Amprolium ion
CID 2178
4-N-(3-bromophenyl)-7-N-methylpyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328252
N-Benzylquinazolin-4-amine
CID 616573
N-benzyl-2-(pyridin-3-yl)quinazolin-4-amine
CID 667555

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine?
The IUPAC name of N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine (CID 62009476) is N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine.
What is the SMILES notation for N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine?
The canonical SMILES for N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine is CNC1CCCc2nc(-c3cccnc3)ncc21.
What is the InChIKey of N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine?
The InChIKey is YQFLYSBTCGRLLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c1-15-12-5-2-6-13-11(12)9-17-14(18-13)10-4-3-7-16-8-10/h3-4,7-9,12,15H,2,5-6H2,1H3.
What are the key properties of N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine?
N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine has a molecular weight of 240.31 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-amine is sourced from PubChem (CID 62009476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).