ethane;4-pent-1-en-2-ylpyridin-2-amine

C12H20N2 — CID 142560511

IUPACethane;4-pent-1-en-2-ylpyridin-2-amine
SMILESC=C(CCC)c1ccnc(N)c1.CC
InChIInChI=1S/C10H14N2.C2H6/c1-3-4-8(2)9-5-6-12-10(11)7-9;1-2/h5-7H,2-4H2,1H3,(H2,11,12);1-2H3
InChIKeyPWSQBFKYDMCOOR-UHFFFAOYSA-N
MW192.31 g/mol
LogP3.50
Rot. Bonds3

About ethane;4-pent-1-en-2-ylpyridin-2-amine

ethane;4-pent-1-en-2-ylpyridin-2-amine (PubChem CID 142560511) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is ethane;4-pent-1-en-2-ylpyridin-2-amine.

Molecular Properties

Compound Nameethane;4-pent-1-en-2-ylpyridin-2-amine
PubChem CID142560511
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Nameethane;4-pent-1-en-2-ylpyridin-2-amine
SMILESC=C(CCC)c1ccnc(N)c1.CC
InChIInChI=1S/C10H14N2.C2H6/c1-3-4-8(2)9-5-6-12-10(11)7-9;1-2/h5-7H,2-4H2,1H3,(H2,11,12);1-2H3
InChIKeyPWSQBFKYDMCOOR-UHFFFAOYSA-N
XLogP3.50
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4-pent-1-en-2-ylpyridin-2-amine?
The IUPAC name of ethane;4-pent-1-en-2-ylpyridin-2-amine (CID 142560511) is ethane;4-pent-1-en-2-ylpyridin-2-amine.
What is the SMILES notation for ethane;4-pent-1-en-2-ylpyridin-2-amine?
The canonical SMILES for ethane;4-pent-1-en-2-ylpyridin-2-amine is C=C(CCC)c1ccnc(N)c1.CC.
What is the InChIKey of ethane;4-pent-1-en-2-ylpyridin-2-amine?
The InChIKey is PWSQBFKYDMCOOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2.C2H6/c1-3-4-8(2)9-5-6-12-10(11)7-9;1-2/h5-7H,2-4H2,1H3,(H2,11,12);1-2H3.
What are the key properties of ethane;4-pent-1-en-2-ylpyridin-2-amine?
ethane;4-pent-1-en-2-ylpyridin-2-amine has a molecular weight of 192.31 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-pent-1-en-2-ylpyridin-2-amine is sourced from PubChem (CID 142560511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).