N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine

C10H16N4 — CID 83878191

IUPACN-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine
SMILESCNCc1cc(N2CCCC2)ncn1
InChIInChI=1S/C10H16N4/c1-11-7-9-6-10(13-8-12-9)14-4-2-3-5-14/h6,8,11H,2-5,7H2,1H3
InChIKeyLIEQGXUYVIFSIA-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.80
Rot. Bonds3

About N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine

N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine (PubChem CID 83878191) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine
PubChem CID83878191
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC NameN-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine
SMILESCNCc1cc(N2CCCC2)ncn1
InChIInChI=1S/C10H16N4/c1-11-7-9-6-10(13-8-12-9)14-4-2-3-5-14/h6,8,11H,2-5,7H2,1H3
InChIKeyLIEQGXUYVIFSIA-UHFFFAOYSA-N
XLogP0.80
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(chloromethyl)-6-pyrrolidin-1-ylpyrimidine;hydrochloride
CID 21245788
1-(6-piperidin-1-ylpyrimidin-4-yl)azepane
CID 112856077
1-[2-(azocan-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 62280361
1-(6-ethylpyrimidin-4-yl)-N-methylpiperidin-3-amine
CID 62545846
1-(6-ethylpyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
CID 166605798
4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine
CID 112856002
1-[2-(azepan-1-yl)-6-ethyl-4-pyridinyl]-N-methylmethanamine
CID 113381283
N-(pyridin-2-ylmethyl)-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 112855662
[6-(azepan-1-yl)pyrimidin-4-yl]hydrazine
CID 80927859
4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine
CID 122282402
5-methyl-3-[[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methyl]-1,2-oxazole
CID 166600931
N-[1-(6-ethylpyrimidin-4-yl)piperidin-3-yl]-2-(methylamino)acetamide;hydrochloride
CID 120704514

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine?
The IUPAC name of N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine (CID 83878191) is N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine is CNCc1cc(N2CCCC2)ncn1.
What is the InChIKey of N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine?
The InChIKey is LIEQGXUYVIFSIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-11-7-9-6-10(13-8-12-9)14-4-2-3-5-14/h6,8,11H,2-5,7H2,1H3.
What are the key properties of N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine?
N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine has a molecular weight of 192.27 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(6-pyrrolidin-1-ylpyrimidin-4-yl)methanamine is sourced from PubChem (CID 83878191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).