ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine

C11H18N2 — CID 143812008

IUPACethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine
SMILESCC.Cc1cccc(C2(N)CC2)n1
InChIInChI=1S/C9H12N2.C2H6/c1-7-3-2-4-8(11-7)9(10)5-6-9;1-2/h2-4H,5-6,10H2,1H3;1-2H3
InChIKeyTZMUWVNIMCHHPN-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.36
Rot. Bonds1

About ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine

ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine (PubChem CID 143812008) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine.

Molecular Properties

Compound Nameethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine
PubChem CID143812008
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Nameethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine
SMILESCC.Cc1cccc(C2(N)CC2)n1
InChIInChI=1S/C9H12N2.C2H6/c1-7-3-2-4-8(11-7)9(10)5-6-9;1-2/h2-4H,5-6,10H2,1H3;1-2H3
InChIKeyTZMUWVNIMCHHPN-UHFFFAOYSA-N
XLogP2.36
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine?
The IUPAC name of ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine (CID 143812008) is ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine.
What is the SMILES notation for ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine?
The canonical SMILES for ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine is CC.Cc1cccc(C2(N)CC2)n1.
What is the InChIKey of ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine?
The InChIKey is TZMUWVNIMCHHPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2.C2H6/c1-7-3-2-4-8(11-7)9(10)5-6-9;1-2/h2-4H,5-6,10H2,1H3;1-2H3.
What are the key properties of ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine?
ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine has a molecular weight of 178.28 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(6-methyl-2-pyridinyl)cyclopropan-1-amine is sourced from PubChem (CID 143812008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).