N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine

C12H19N3 — CID 65421319

IUPACN-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ccnc(C2CC2C)n1
InChIInChI=1S/C12H19N3/c1-8(2)14-7-10-4-5-13-12(15-10)11-6-9(11)3/h4-5,8-9,11,14H,6-7H2,1-3H3
InChIKeySTQBDCKQZXIVEB-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.10
Rot. Bonds4

About N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine

N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine (PubChem CID 65421319) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine
PubChem CID65421319
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ccnc(C2CC2C)n1
InChIInChI=1S/C12H19N3/c1-8(2)14-7-10-4-5-13-12(15-10)11-6-9(11)3/h4-5,8-9,11,14H,6-7H2,1-3H3
InChIKeySTQBDCKQZXIVEB-UHFFFAOYSA-N
XLogP2.10
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[2-(2-methylcyclopropyl)pyrimidin-4-yl]methanamine
CID 65421316
N-[[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methyl]propan-2-amine
CID 65402599
N-[[2-(oxolan-2-yl)pyrimidin-4-yl]methyl]propan-2-amine
CID 65328670
N-[[2-(3-ethyl-1,4-dithian-2-yl)pyrimidin-4-yl]methyl]propan-2-amine
CID 115388779
N-[[2-(1,4-oxathian-2-yl)pyrimidin-4-yl]methyl]propan-2-amine
CID 79968702
N-[(2-bromopyrimidin-4-yl)methyl]propan-2-amine
CID 130113665
N-[(2-pyrimidin-2-ylpyrimidin-4-yl)methyl]propan-2-amine
CID 55114824
1-(2-cyclobutylpyrimidin-4-yl)-N-methylmethanamine
CID 64985841
1-(2-cyclohexylpyrimidin-4-yl)-N-methylmethanamine
CID 62747376
N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine
CID 65402198
[2-(2-methylcyclopropyl)pyrimidin-4-yl]hydrazine
CID 65422392
N-[[2-(3-methylfuran-2-yl)pyrimidin-4-yl]methyl]propan-2-amine
CID 113455494

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine (CID 65421319) is N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine is CC(C)NCc1ccnc(C2CC2C)n1.
What is the InChIKey of N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine?
The InChIKey is STQBDCKQZXIVEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-8(2)14-7-10-4-5-13-12(15-10)11-6-9(11)3/h4-5,8-9,11,14H,6-7H2,1-3H3.
What are the key properties of N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine?
N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine has a molecular weight of 205.31 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 65421319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).