N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine

C14H21N3 — CID 114206909

IUPACN-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine
SMILESCCCc1ncc(CNC2CC2)c(C2CC2)n1
InChIInChI=1S/C14H21N3/c1-2-3-13-16-9-11(8-15-12-6-7-12)14(17-13)10-4-5-10/h9-10,12,15H,2-8H2,1H3
InChIKeyRFIKBSCOFWHWSW-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.56
Rot. Bonds6

About N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine

N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine (PubChem CID 114206909) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine
PubChem CID114206909
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC NameN-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine
SMILESCCCc1ncc(CNC2CC2)c(C2CC2)n1
InChIInChI=1S/C14H21N3/c1-2-3-13-16-9-11(8-15-12-6-7-12)14(17-13)10-4-5-10/h9-10,12,15H,2-8H2,1H3
InChIKeyRFIKBSCOFWHWSW-UHFFFAOYSA-N
XLogP2.56
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-cyclopropyl-2-(2-ethoxyethyl)pyrimidin-5-yl]-N-methylmethanamine
CID 114206875
N-[[4-cyclopropyl-2-(2-methoxyethyl)pyrimidin-5-yl]methyl]propan-2-amine
CID 114206901
N,4-dicyclopropyl-5-(propylaminomethyl)pyrimidin-2-amine
CID 114206896
N-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]cyclopropanamine
CID 60722113
N-[[4-methyl-2-(methylsulfonylmethyl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 114206498
N-[(2,4-dichloropyrimidin-5-yl)methyl]cyclopropanamine
CID 53385527
5-[(cyclopropylamino)methyl]-4-methyl-N-propan-2-yl-N-propylpyrimidin-2-amine
CID 83185509
5-[(cyclopropylamino)methyl]-N,N-diethyl-2-methylpyridin-4-amine
CID 81248791
1-[4-cyclopropyl-2-(phenylmethoxymethyl)pyrimidin-5-yl]-N-methylmethanamine
CID 165343676
N-[(4-cyclopropylpyrimidin-2-yl)methyl]cyclopropanamine
CID 63318876
N-[[4-cyclopropyl-2-(oxolan-2-yl)pyrimidin-5-yl]methyl]ethanamine
CID 114206879
N-[[4-(3,5-dimethylpyrazol-1-yl)-6-methyl-3-pyridinyl]methyl]cyclopropanamine
CID 81254175

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine (CID 114206909) is N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine is CCCc1ncc(CNC2CC2)c(C2CC2)n1.
What is the InChIKey of N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine?
The InChIKey is RFIKBSCOFWHWSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-2-3-13-16-9-11(8-15-12-6-7-12)14(17-13)10-4-5-10/h9-10,12,15H,2-8H2,1H3.
What are the key properties of N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine?
N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine has a molecular weight of 231.34 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclopropyl-2-propylpyrimidin-5-yl)methyl]cyclopropanamine is sourced from PubChem (CID 114206909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).