N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine

C10H14N4 — CID 79507389

IUPACN-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
SMILESCc1nccc(CNC2=NCCC2)n1
InChIInChI=1S/C10H14N4/c1-8-11-6-4-9(14-8)7-13-10-3-2-5-12-10/h4,6H,2-3,5,7H2,1H3,(H,12,13)
InChIKeyOPGGJOFFVWJKDV-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.07
Rot. Bonds2

About N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine

N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine (PubChem CID 79507389) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine.

Molecular Properties

Compound NameN-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
PubChem CID79507389
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC NameN-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
SMILESCc1nccc(CNC2=NCCC2)n1
InChIInChI=1S/C10H14N4/c1-8-11-6-4-9(14-8)7-13-10-3-2-5-12-10/h4,6H,2-3,5,7H2,1H3,(H,12,13)
InChIKeyOPGGJOFFVWJKDV-UHFFFAOYSA-N
XLogP1.07
TPSA50.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-[(2-methylpyrimidin-4-yl)methyl]pyrimidin-2-amine
CID 63207972
3-methyl-N-[(2-methylpyrimidin-4-yl)methyl]-1,2,4-oxadiazol-5-amine
CID 106659595
3-[(2-methylpyrimidin-4-yl)methylamino]cyclopent-2-en-1-one
CID 104788316
N-[(2-methylpyrimidin-4-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine
CID 62746951
N-(pyridin-4-ylmethyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 2123179
6-methyl-N-[(2-methylpyrimidin-4-yl)methyl]pyrimidin-4-amine
CID 61224152
5-methyl-2-[(2-methylpyrimidin-4-yl)methylamino]-1,3-thiazole-4-carboxylic acid
CID 115423761
N-[(2-methylpyrimidin-4-yl)methyl]cyclohexanamine
CID 60962032
N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
CID 20595374
4-bromo-N-[(2-methylpyrimidin-4-yl)methyl]aniline
CID 62747499
2-N-[(2-methylpyrimidin-4-yl)methyl]pyrimidine-2,4-diamine
CID 116795587
6-chloro-4-N-methyl-2-N-[(2-methylpyrimidin-4-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 80813733

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine?
The IUPAC name of N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine (CID 79507389) is N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine.
What is the SMILES notation for N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine?
The canonical SMILES for N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine is Cc1nccc(CNC2=NCCC2)n1.
What is the InChIKey of N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine?
The InChIKey is OPGGJOFFVWJKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-8-11-6-4-9(14-8)7-13-10-3-2-5-12-10/h4,6H,2-3,5,7H2,1H3,(H,12,13).
What are the key properties of N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine?
N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine has a molecular weight of 190.25 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrimidin-4-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine is sourced from PubChem (CID 79507389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).