N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine

C17H19N3 — CID 65403495

IUPACN-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine
SMILESc1ccc2c(c1)CC(c1ncc(CNC3CC3)cn1)C2
InChIInChI=1S/C17H19N3/c1-2-4-14-8-15(7-13(14)3-1)17-19-10-12(11-20-17)9-18-16-5-6-16/h1-4,10-11,15-16,18H,5-9H2
InChIKeyAJFYGFSIVLJUFU-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.61
Rot. Bonds4

About N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine

N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine (PubChem CID 65403495) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine
PubChem CID65403495
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine
SMILESc1ccc2c(c1)CC(c1ncc(CNC3CC3)cn1)C2
InChIInChI=1S/C17H19N3/c1-2-4-14-8-15(7-13(14)3-1)17-19-10-12(11-20-17)9-18-16-5-6-16/h1-4,10-11,15-16,18H,5-9H2
InChIKeyAJFYGFSIVLJUFU-UHFFFAOYSA-N
XLogP2.61
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 65403690
N-[(2-cyclopropylpyrimidin-5-yl)methyl]cyclopropanamine
CID 62757323
[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methanamine
CID 65404660
N-[[2-(4-ethylcyclohexyl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 65391135
N-[[2-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidin-5-yl]methyl]propan-1-amine
CID 65406026
N-[[2-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidin-4-yl]methyl]cyclopropanamine
CID 65405051
4-[(2-cyclohexylpyrimidin-5-yl)methylamino]-1-phenylpyrrolidin-2-one
CID 56882134
N-[(2-naphthalen-2-ylpyrimidin-5-yl)methyl]cyclopropanamine
CID 62756229
N-[[2-(3,4-dihydro-2H-chromen-3-yl)pyrimidin-5-yl]methyl]propan-1-amine
CID 65405832
N-[(6-methyl-3-pyridinyl)methyl]cyclopropanamine
CID 43163855
N-[(6-chloro-3-pyridinyl)methyl]cyclopropanamine
CID 53385515
N-[[2-(azepan-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 55113924

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine (CID 65403495) is N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine is c1ccc2c(c1)CC(c1ncc(CNC3CC3)cn1)C2.
What is the InChIKey of N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine?
The InChIKey is AJFYGFSIVLJUFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-2-4-14-8-15(7-13(14)3-1)17-19-10-12(11-20-17)9-18-16-5-6-16/h1-4,10-11,15-16,18H,5-9H2.
What are the key properties of N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine?
N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine has a molecular weight of 265.36 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,3-dihydro-1H-inden-2-yl)pyrimidin-5-yl]methyl]cyclopropanamine is sourced from PubChem (CID 65403495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).