5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine

C11H17N3 — CID 146532311

IUPAC5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine
SMILESC/C=C\N=c1/ccc(C(C)C)cn1N
InChIInChI=1S/C11H17N3/c1-4-7-13-11-6-5-10(9(2)3)8-14(11)12/h4-9H,12H2,1-3H3/b7-4-,13-11+
InChIKeyAZDXIGAUXKHNTD-HCIJKTMESA-N
MW191.28 g/mol
LogP1.76
Rot. Bonds2

About 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine

5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine (PubChem CID 146532311) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine.

Molecular Properties

Compound Name5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine
PubChem CID146532311
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine
SMILESC/C=C\N=c1/ccc(C(C)C)cn1N
InChIInChI=1S/C11H17N3/c1-4-7-13-11-6-5-10(9(2)3)8-14(11)12/h4-9H,12H2,1-3H3/b7-4-,13-11+
InChIKeyAZDXIGAUXKHNTD-HCIJKTMESA-N
XLogP1.76
TPSA43.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine?
The IUPAC name of 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine (CID 146532311) is 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine.
What is the SMILES notation for 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine?
The canonical SMILES for 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine is C/C=C\N=c1/ccc(C(C)C)cn1N.
What is the InChIKey of 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine?
The InChIKey is AZDXIGAUXKHNTD-HCIJKTMESA-N. The full InChI is InChI=1S/C11H17N3/c1-4-7-13-11-6-5-10(9(2)3)8-14(11)12/h4-9H,12H2,1-3H3/b7-4-,13-11+.
What are the key properties of 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine?
5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine has a molecular weight of 191.28 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-2-[(Z)-prop-1-enyl]iminopyridin-1-amine is sourced from PubChem (CID 146532311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).