N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine

C10H15N3 — CID 130636866

IUPACN-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine
SMILESCc1nccc(CN(C)C2CC2)n1
InChIInChI=1S/C10H15N3/c1-8-11-6-5-9(12-8)7-13(2)10-3-4-10/h5-6,10H,3-4,7H2,1-2H3
InChIKeyFVQICSRUGPEEPR-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.38
Rot. Bonds3

About N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine

N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine (PubChem CID 130636866) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine
PubChem CID130636866
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine
SMILESCc1nccc(CN(C)C2CC2)n1
InChIInChI=1S/C10H15N3/c1-8-11-6-5-9(12-8)7-13(2)10-3-4-10/h5-6,10H,3-4,7H2,1-2H3
InChIKeyFVQICSRUGPEEPR-UHFFFAOYSA-N
XLogP1.38
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine?
The IUPAC name of N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine (CID 130636866) is N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine?
The canonical SMILES for N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine is Cc1nccc(CN(C)C2CC2)n1.
What is the InChIKey of N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine?
The InChIKey is FVQICSRUGPEEPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-8-11-6-5-9(12-8)7-13(2)10-3-4-10/h5-6,10H,3-4,7H2,1-2H3.
What are the key properties of N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine?
N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine has a molecular weight of 177.25 g/mol, XLogP of 1.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylpyrimidin-4-yl)methyl]cyclopropanamine is sourced from PubChem (CID 130636866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).