N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

C16H19N3 — CID 63250535

IUPACN-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
SMILESCNC(c1cncnc1)C1CCCc2ccccc21
InChIInChI=1S/C16H19N3/c1-17-16(13-9-18-11-19-10-13)15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,9-11,15-17H,4,6,8H2,1H3
InChIKeyMSGAXBXUEOKZIZ-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.86
Rot. Bonds3

About N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine (PubChem CID 63250535) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
PubChem CID63250535
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC NameN-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
SMILESCNC(c1cncnc1)C1CCCc2ccccc21
InChIInChI=1S/C16H19N3/c1-17-16(13-9-18-11-19-10-13)15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,9-11,15-17H,4,6,8H2,1H3
InChIKeyMSGAXBXUEOKZIZ-UHFFFAOYSA-N
XLogP2.86
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[pyrimidin-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 105218815
N-methyl-1-(4-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 62718728
1-(2-fluorophenyl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63250536
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 65412087
1-(5-bromothiophen-2-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63503087
1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63508230
2,3-dihydro-1H-inden-1-yl(pyrimidin-5-yl)methanol
CID 65409603
N-[(4-bromophenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]ethanamine
CID 63509295
ethane;1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 144539733
[(3,5-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 105218933
N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
CID 63251085
(1S)-N-[(1-methyltetrazol-5-yl)methyl]-1-phenyl-1-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine
CID 124872026

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The IUPAC name of N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine (CID 63250535) is N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine.
What is the SMILES notation for N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The canonical SMILES for N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine is CNC(c1cncnc1)C1CCCc2ccccc21.
What is the InChIKey of N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The InChIKey is MSGAXBXUEOKZIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-17-16(13-9-18-11-19-10-13)15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,9-11,15-17H,4,6,8H2,1H3.
What are the key properties of N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine has a molecular weight of 253.35 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine is sourced from PubChem (CID 63250535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).