N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine

C14H16N4 — CID 82513399

IUPACN-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine
SMILESCN(c1ccc2c(c1)NCCC2)c1ncccn1
InChIInChI=1S/C14H16N4/c1-18(14-16-8-3-9-17-14)12-6-5-11-4-2-7-15-13(11)10-12/h3,5-6,8-10,15H,2,4,7H2,1H3
InChIKeyUAHFTONORQLANY-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.60
Rot. Bonds2

About N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine

N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine (PubChem CID 82513399) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine.

Molecular Properties

Compound NameN-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine
PubChem CID82513399
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC NameN-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine
SMILESCN(c1ccc2c(c1)NCCC2)c1ncccn1
InChIInChI=1S/C14H16N4/c1-18(14-16-8-3-9-17-14)12-6-5-11-4-2-7-15-13(11)10-12/h3,5-6,8-10,15H,2,4,7H2,1H3
InChIKeyUAHFTONORQLANY-UHFFFAOYSA-N
XLogP2.60
TPSA41.05 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 ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-N-methyl-1,2,3,4-tetrahydroquinolin-7-amine
CID 81215309
N,N,N'-trimethyl-N'-(1,2,3,4-tetrahydroquinolin-7-yl)ethane-1,2-diamine
CID 81215028
N-cyclohexyl-N-methyl-1,2,3,4-tetrahydroquinolin-7-amine
CID 81215187
N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine
CID 81214759
2-[methyl(1,2,3,4-tetrahydroquinolin-7-yl)amino]acetamide
CID 81215351
N-butyl-N-ethyl-1,2,3,4-tetrahydroquinolin-7-amine
CID 81217490
N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinolin-7-amine
CID 81215273
ethane;7-methyl-1,2,3,4-tetrahydroquinoline
CID 142224426
7-butoxy-1,2,3,4-tetrahydroquinoline
CID 107313953
N-(2-methoxyethyl)-2-[methyl(1,2,3,4-tetrahydroquinolin-7-yl)amino]acetamide
CID 81214860
N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-7-amine
CID 81214678
7-pentoxy-1,2,3,4-tetrahydroquinoline
CID 107313970

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine?
The IUPAC name of N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine (CID 82513399) is N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine.
What is the SMILES notation for N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine?
The canonical SMILES for N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine is CN(c1ccc2c(c1)NCCC2)c1ncccn1.
What is the InChIKey of N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine?
The InChIKey is UAHFTONORQLANY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c1-18(14-16-8-3-9-17-14)12-6-5-11-4-2-7-15-13(11)10-12/h3,5-6,8-10,15H,2,4,7H2,1H3.
What are the key properties of N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine?
N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine has a molecular weight of 240.31 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-pyrimidin-2-yl-1,2,3,4-tetrahydroquinolin-7-amine is sourced from PubChem (CID 82513399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).